cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.25592/dgs.corpus-type-79022
title: ABSCHALTEN-KOPF1^ (MEINE DGS – annotiert. Öffentliches Korpus der Deutschen Gebärdensprache, mehrere Releases)
title: TO-SWITCH-OFF-HEAD1^ (MY DGS – annotated. Public Corpus of German Sign Language, several releases)

description: Ein Type aus der Annotation von MEINEDGS mit allen seinen Tokens aus MEINEDGS: The Public DGS Corpus consists of more than 50 hours of video data from the DGS-Korpus project made available together with annotations for research purposes. In this project, data were collected all across Germany in the timeframe 2010-2012. The public corpus shows 330 informants in 4 different age groups (from 18 years on) from 13 different regions. All parts are conversations between two informants in German Sign Language (DGS). The majority of transcripts included cover discussions and reports on Deaf life and personal experiences, although there are examples of other tasks such as story retellings as well.<br>Transcripts are made available in iLex and ELAN format as well as in SRT subtitles format that can be imported in MaxQDA and other analysis tools, together with the mp4 video files in 360p50. Über diese versionsunabhängige DOI ist die jeweils neueste Version des Datensatzes auffindbar.
description: A type from the annotation of MYDGS including all its tokens in MYDGS: Das Öffentliche DGS-Korpus besteht aus mehr als 50 Stunden Video aus dem Projekt DGS-Korpus , die zusammen mit Annotationen für Forschungszwecke zur Verfügung gestellt werden. Die Datenerhebung im Projekt fand im Zeitraum 2010-2012 in ganz Deutschland statt. Das öffentliche Korpus besteht aus Gesprächen jeweils zweier Informantinnen oder Informanten in Deutscher Gebärdensprache. Das Korpus umfasst 330 Informantinnen und Informanten in vier verschiedenen Altersgruppen (ab 18 Jahren) aus 13 verschiedenen Regionen. Der Schwerpunkt der Sammlung liegt auf Transkripten von Diskussionen und Berichten über das Leben Gehörloser sowie persönliche Erfahrungen, sie enthält aber auch Beispiele anderer Erhebungsformate wie Nacherzählungen.<br>Transkripte werden im iLex- und ELAN-Format sowie als SRT-Untertiteldateien (zum Import etwa in MaxQDA) zur Verfügung gestellt. Die zugehörigen MP4-Videodaten sind durchgängig im Format 360p50. This version-dependent DOI allows you to find the latest version of the dataset.
DOI: 10.5517/ccdc.csd.cc208t37
title: CCDC 1855508: Experimental Crystal Structure Determination

description: Related Article: Nehmedo G. Fawzy, Siva S. Panda, Walid Fayad, ElSayed M. Shalaby, Aladdin M. Srour, Adel S. Girgis
|2019|RSC Advances|9|33761|doi:10.1039/C9RA05661K
DOI: 10.5517/ccdc.csd.cc208t48
title: CCDC 1855509: Experimental Crystal Structure Determination

description: Related Article: Nehmedo G. Fawzy, Siva S. Panda, Walid Fayad, ElSayed M. Shalaby, Aladdin M. Srour, Adel S. Girgis
|2019|RSC Advances|9|33761|doi:10.1039/C9RA05661K
DOI: 10.25318/1010003201-fra
title: Bénéfice net des régies des alcools provinciales et territoriales et recettes des administrations publiques provenant directement du contrôle et de la vente des boissons alcoolisées, exercices financiers se terminant le 31 mars

description: Ce tableau contient 180 seriés, avec des données pour les années 1993 - 2013 (il n'y a pas nécessairement de données pour toutes les années pour l'ensemble des combinaisons), et sa dernière date de diffusion remonte au 2015-05-04. Ce tableau contient des données telles que décrites par les dimensions suivantes (les combinaisons ne sont pas toutes disponibles): Géographie (15 éléments: Canada;Terre-Neuve-et-Labrador;Nouvelle-Écosse;Île-du-Prince-Édouard ...), Régies des alcools (12 éléments: Ventes brutes (Taxe sur les biens et service (TPS) comprise);Déduction : Taxe sur les biens et service (TPS);Ventes nettes;Déduction : prix de revient des produits vendus ...).
DOI: 10.25318/2110005601-eng
title: Sound recording and music publishing, industry expenditures

description: The operating expenses by North American Industry Classification System (NAICS) which include all members under industry expenditures, sound recording industries (NAICS 5122), annual (percent), for five years of data.
DOI: 10.25318/2110005601-fra
title: Enregistrement sonore et édition de musique, dépenses de l'industrie

description: Les dépenses d'exploitation selon le Système de classification des industries de l'Amérique du Nord (SCIAN) pour tous les membres sous les industries de l'enregistrement sonore (SCIAN 5122), annuel (pourcentage), couvrant cinq années de données.
DOI: 10.25318/2110005701-fra
title: Divertissement et loisirs, statistiques sommaires

description: Les statistiques sommaires selon le Système de classification des industries de l'Amérique du Nord (SCIAN) : revenu d'exploitation (dollars x 1 000 000), dépenses d'exploitation (dollars x 1 000 000), salaires, traitements et avantages sociaux (dollars x 1 000 000), et marge bénéficiaire d'exploitation (pourcentange) pour tous les SCIAN sous parcs d'attractions et salles de jeux électroniques (7131) et autres services de divertissement et de loisirs (7139), données annuelles, couvrant quatre années de données.
DOI: 10.25318/3610030601-eng
title: Labour statistics consistent with the System of National Accounts, by sector, job category and North American Industry Classification System (NAICS), S-level aggregation

description: This table contains 11685 series, with data for years 1997 - 2011 (not all combinations necessarily have data for all years), and was last released on 2013-05-15. This table contains data described by the following dimensions (Not all combinations are available): Geography (15 items: Newfoundland and Labrador; Canada; Nova Scotia; Prince Edward Island ...), Sector (3 items: Total economy; Non-business sector; Business sector ...), Labour productivity measures and related measures (15 items: Total number of jobs; Number of employee jobs; Number of self-employed jobs; Hours worked for all jobs ...), North American Industry Classification System (NAICS) (19 items: All industries; Agriculture; forestry; fishing and hunting ...).
DOI: 10.25318/3610030601-fra
title: Statistiques du travail conformes au Système de comptabilité nationale, selon le secteur, la catégorie d'emploi et le Système de classification des industries de l'Amérique du Nord (SCIAN), agrégation au niveau S

description: Ce tableau contient 11685 séries, avec des données pour les années 1997 - 2011 (il n'y a pas nécessairement de données pour toutes les années pour l'ensemble des combinaisons), et sa dernière date de diffusion remonte au 2013-05-15. Ce tableau contient des données telles que décrites par les dimensions suivantes (les combinaisons ne sont pas toutes disponibles) : Géographie (15 éléments : Terre-Neuve-et-Labrador; Île-du-Prince-Édouard; Nouvelle-Écosse; Canada ...), Secteur (3 éléments : Ensemble de l'économie; Secteur des entreprises; Secteur non commercial ...), Mesures de productivité du travail et variables connexes (15 éléments : Nombre total d'emplois; Nombre d'emplois salariés; Heures travaillées pour tous les emplois; Nombre d'emplois occupés par des travailleurs autonomes ...), Système de classification des industries de l'Amérique du Nord (SCIAN) (19 éléments: Ensemble des industries; Agriculture; foresterie; pêche et chasse ...).
DOI: 10.25318/3610042801-eng
title: Inputs and outputs, by industry and commodity, M-level aggregation

description: This table contains 4162 series, with data for years 1961 - 1997 (not all combinations necessarily have data for all years). This table contains data described by the following dimensions (Not all combinations are available): Unit of measure (1 items: Dollars ...) Geography (1 items: Canada ...) Inputs-outputs (2 items: Inputs; Outputs ...) Industry (59 items: Total industries; Logging and forestry industries; Fishing and trapping industries; Agricultural and related services industries ...) Commodity (110 items: Total commodities; Live animals; Other agricultural products; Grains ...).
DOI: 10.25318/3610042901-eng
title: Financial flows, chartered banks, quarterly, 1961 - 2012

description: This table contains 29 series, with data for years 1961 - 2012 (not all combinations necessarily have data for all years), and is no longer being released. This table contains data described by the following dimensions (Not all combinations are available): Geography (1 item: Canada);  Category flows (29 items: Gross saving and capital transfers; Capital consumption allowances; Saving; Non-financial investment; ...).
DOI: 10.25318/3610042901-fra
title: Flux financiers, banques à charte, trimestriel, 1961 - 2012

description: Ce tableau contient 29 séries, avec des données pour les années 1961 - 2012 (il n'y a pas nécessairement de données pour toutes les années pour l'ensemble des combinaisons), et sa mise à jour n'a plus lieu. Ce tableau contient des données telles que décrites par les dimensions suivantes (Les combinaisons ne sont pas toutes disponibles) : Géographie (1 élément : Canada) ; Flux catégories (29 éléments : Épargne brute et transferts de capitaux; Provisions pour consommation de capital; Épargne; Investissement non financier; ...).
DOI: 10.5517/ccdc.csd.cc20gkqs
title: CCDC 1861045: Experimental Crystal Structure Determination

description: Related Article: Paul S. Riehl, Daniel J. Nasrallah, Corinna S. Schindler|2019|Chemical Science|10|10267|doi:10.1039/c9sc03716k
DOI: 10.5517/ccdc.csd.cc20gkrt
title: CCDC 1861046: Experimental Crystal Structure Determination

description: Related Article: Paul S. Riehl, Daniel J. Nasrallah, Corinna S. Schindler|2019|Chemical Science|10|10267|doi:10.1039/c9sc03716k
DOI: 10.5517/ccdc.csd.cc20q081
title: CCDC 1868192: Experimental Crystal Structure Determination

description: Related Article: Tian-Shu Zhang, Hongping Zhang, Rong Fu, Jianyi Wang, Wen-Juan Hao, Shu-Jiang Tu, Bo Jiang|2019|Chem.Commun.|55|13231|doi:10.1039/C9CC07236E
DOI: 10.25318/3610030501-eng
title: Indexes of labour productivity and related variables, by industry according to the Canadian System of National Accounts

description: This table contains 1998 series, with data for years 1946 - 2001 (not all combinations necessarily have data for all years), and was last released on 2007-03-06. This table contains data described by the following dimensions (Not all combinations are available): Geography (1 items: Canada ...), Labour productivity measures and related measures (9 items: Real value added; Total number of jobs; Annual average number of hours worked for all jobs; Hours worked for all jobs ...), Industries, by aggregation (222 items: Total economy; special aggregation; Business sector - goods; special aggregation; Business sector - services; special aggregation; Business sector; special aggregation ...).
DOI: 10.25318/1010000901-eng
title:  Foreign exchange rates in Canadian dollars, Bank of Canada, monthly

description: This table contains 45 series, with data for years 1950 - 2015 (not all combinations necessarily have data for all years), and was last released on 2016-01-05. This table contains data described by the following dimensions (Not all combinations are available): Geography (1 items: Canada ...), Type of currency (45 items: United States dollar; noon spot rate; average; Danish krone; noon spot rate; average; French franc; noon spot rate; average; Belgian franc; noon spot rate; average ...).
DOI: 10.25318/2110005401-eng
title: Periodical publishers, industry expenditures

description: The operating expenses by North American Industry Classification System (NAICS) which include all members under industry expenditures, for periodical publishers (NAICS 511120), annual (percent), for three years of data.
DOI: 10.14272/iaavpebekxnfbu-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C13H10F6S/c14-12(15,16)8-1-9(13(17,18)19)3-10(2-8)20-11-4-7(5-11)6-11/h1-3,7H,4-6H2

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, CDCl3, ppm) δ = 7.86–7.83 (m, 2H), 7.74–7.72 (m, 1H), 2.81 (s, 1H), 2.05 (s, 6H).
DOI: 10.14272/iaavpebekxnfbu-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C13H10F6S/c14-12(15,16)8-1-9(13(17,18)19)3-10(2-8)20-11-4-7(5-11)6-11/h1-3,7H,4-6H2

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (100 MHz, CDCl3, ppm) δ = 138.5 (2C), 132.6–131.6 (m, 2C), 127.7–127.5 (m), 123.2 (q, J = 273.0 Hz, 2C), 121.0–120.7 (m), 54.4 (3C), 45.1, 29.5.
DOI: 10.14272/obipjsiylrcgjr-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C11H11NO5S/c13-8-1-2-9(12(14)15)10(3-8)18(16,17)11-4-7(5-11)6-11/h1-3,7,13H,4-6H2

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, ppm) δ = 7.89 (d, J = 8.8 Hz, 1H, Ar-H), 7.65 (d, J = 2.7 Hz, 1H, Ar-H), 7.19 (dd, J = 8.8, 2.7 Hz, 1H, Ar-H), 2.79 (s, 1H), 2.34 (s, 6H). 1H is missing (1H, OH).
DOI: 10.14272/obipjsiylrcgjr-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C11H11NO5S/c13-8-1-2-9(12(14)15)10(3-8)18(16,17)11-4-7(5-11)6-11/h1-3,7,13H,4-6H2

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (100 MHz, ppm) δ = 176.1 (Cquat, CArOH), 160.0 (Cquat, CArNO2), 133.8 (Cquat, CArS), 128.1 (+, CHAr), 121.0 (+, CHAr), 119.0 (+, CHAr), 57.2 (Cquat, CCH2), 52.6 (–, 3x CH2), 26.2 (+, CH).
DOI: 10.14272/phpyrtseamtsei-uhfffaoysa-n.1
title: S-(3-chlorophenyl)-S-bicyclo[1.1.1]pentylsulfoximine
title: InChI=1S/C11H12ClNOS/c12-9-2-1-3-10(4-9)15(13,14)11-5-8(6-11)7-11/h1-4,8,13H,5-7H2

description: This dataset contains experimental data from a sample (InChI=1S/C11H12ClNOS/c12-9-2-1-3-10(4-9)15(13,14)11-5-8(6-11)7-11/h1-4,8,13H,5-7H2). The datasets from the following experiments are available: infrared absorption spectroscopy (IR) 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) mass spectrometry (MS)
DOI: 10.14272/phpyrtseamtsei-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C11H12ClNOS/c12-9-2-1-3-10(4-9)15(13,14)11-5-8(6-11)7-11/h1-4,8,13H,5-7H2

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (100 MHz, CDCl3, ppm) δ = 141.5, 135.4, 133.3, 130.3, 129.1, 127.3, 56.2, 50.5 (3C), 25.9.
DOI: 10.14272/phpyrtseamtsei-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C11H12ClNOS/c12-9-2-1-3-10(4-9)15(13,14)11-5-8(6-11)7-11/h1-4,8,13H,5-7H2

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3244, 3070, 3003, 2985, 2969, 2917, 2883, 2871, 1574, 1456, 1411, 1228, 1220, 1162, 1137, 1129, 1116, 1086, 1074, 1035, 1003, 986, 975, 941, 912, 901, 874, 820, 788, 772, 677, 666, 599, 548, 514, 487, 460, 424, 409, 402, 388 cm–1.
DOI: 10.14272/hvctuqnwhdbbqx-uhfffaoysa-n.1
title: 1-((2-nitrophenyl)sulfonyl)bicyclo[1.1.1]pentane
title: InChI=1S/C11H11NO4S/c13-12(14)9-3-1-2-4-10(9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: This dataset contains experimental data from a sample (InChI=1S/C11H11NO4S/c13-12(14)9-3-1-2-4-10(9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2). The datasets from the following experiments are available: 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) infrared absorption spectroscopy (IR) mass spectrometry (MS) mass spectrometry (MS) X-ray diffraction (XRD)
DOI: 10.14272/hvctuqnwhdbbqx-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C11H11NO4S/c13-12(14)9-3-1-2-4-10(9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, CDCl3, ppm) δ = 8.08–8.04 (m, 1H), 7.82–7.72 (m, 3H), 2.76 (s, 1H), 2.29 (s, 6H).
DOI: 10.14272/iaavpebekxnfbu-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C13H10F6S/c14-12(15,16)8-1-9(13(17,18)19)3-10(2-8)20-11-4-7(5-11)6-11/h1-3,7H,4-6H2

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 2986, 2970, 2915, 2881, 1350, 1275, 1210, 1174, 1129, 1105, 895, 843, 824, 714, 701, 681 cm–1.
DOI: 10.14272/mruucjcnlwixrl-uhfffaoysa-n.1
title: 1,4-bis(bicyclo[1.1.1]pentylthio)benzene
title: InChI=1S/C16H18S2/c1-2-14(18-16-8-12(9-16)10-16)4-3-13(1)17-15-5-11(6-15)7-15/h1-4,11-12H,5-10H2

description: This dataset contains experimental data from a sample (InChI=1S/C16H18S2/c1-2-14(18-16-8-12(9-16)10-16)4-3-13(1)17-15-5-11(6-15)7-15/h1-4,11-12H,5-10H2). The datasets from the following experiments are available: 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) mass spectrometry (MS) infrared absorption spectroscopy (IR)
DOI: 10.14272/mruucjcnlwixrl-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C16H18S2/c1-2-14(18-16-8-12(9-16)10-16)4-3-13(1)17-15-5-11(6-15)7-15/h1-4,11-12H,5-10H2

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 30 °C): 274 (100) [M]+, 67 (62) [C5H7]+; HRMS (EI, 30 °C): calcd for C16H1832S2 [M]+: 274.0850; found 274.0849.
DOI: 10.14272/mruucjcnlwixrl-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C16H18S2/c1-2-14(18-16-8-12(9-16)10-16)4-3-13(1)17-15-5-11(6-15)7-15/h1-4,11-12H,5-10H2

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, CDCl3, ppm) δ = 7.36 (s, 4H), 2.73 (s, 2H), 1.96 (s, 12H).
DOI: 10.14272/mruucjcnlwixrl-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C16H18S2/c1-2-14(18-16-8-12(9-16)10-16)4-3-13(1)17-15-5-11(6-15)7-15/h1-4,11-12H,5-10H2

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (100 MHz, CDCl3, ppm) δ = 133.7 (2C), 133.6 (4C), 54.2 (6C), 45.6 (2C), 29.0 (2C).
DOI: 10.14272/mruucjcnlwixrl-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C16H18S2/c1-2-14(18-16-8-12(9-16)10-16)4-3-13(1)17-15-5-11(6-15)7-15/h1-4,11-12H,5-10H2

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 2983, 2961, 2907, 2873, 1473, 1460, 1445, 1384, 1201, 1126, 1112, 1094, 1011, 922, 908, 888, 826, 778, 765, 564, 543, 513, 435, 407 cm–1.
DOI: 10.14272/pljoxmuhaaqzqy-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C9H17NOS/c1-8(2,3)12(10,11)9-4-7(5-9)6-9/h7,10H,4-6H2,1-3H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, CDCl3, ppm) δ = 2.74 (s, 1H), 2.30 (s, 6H), 1.43(s, 9H). Missing signal (1H, NH) due to peak broadening.
DOI: 10.14272/vruybciaejxorz-uhfffaoysa-n/chmo0000156
title: X-ray diffraction (XRD) ()
title: InChI=1S/C11H11NO4S/c13-12(14)9-1-3-10(4-2-9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: dataset for X-ray diffraction (XRD) colourless crystals, C11H11NO4S, Mr = 253.27, crystal size 0.16 × 0.08 × 0.06 mm, triclinic, space group P-1 (No. 2), a = 7.3339(3) Å, b = 7.9774(3) Å, c = 10.7533(4) Å, α = 68.613(1)°, β = 76.287(1)°, γ = 85.342(1)°, V = 569.10(4) Å3, Z = 2, ρ = 1.478 Mg/m-3, µ(Cu-Kα) = 2.59 mm-1, F(000) = 264, 2qmax = 144.2°, 11823 reflections, of which 2222 were independent (Rint = 0.027), 157 parameters, 1 restraint, R1 = 0.033 (for 2186 I &gt; 2σ(I)), wR2 = 0.087 (all data), S = 1.06, largest diff. peak / hole = 0.37 / -0.36 e Å-3.
DOI: 10.14272/vruybciaejxorz-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C11H11NO4S/c13-12(14)9-1-3-10(4-2-9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 130 °C): 254 (0.1) [M+H]+, 253 (0.1) [M]+, 170 (3) [M–C5H7SO]+, 67 (100) [C5H7]+.
DOI: 10.14272/vruybciaejxorz-uhfffaoysa-n/chmo0000470.1
title: mass spectrometry (MS) ()
title: InChI=1S/C11H11NO4S/c13-12(14)9-1-3-10(4-2-9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: dataset for mass spectrometry (MS) HRMS (EI, 70 °C): calc for C11H11O4N32S [M]+: 253.0409; found 253.0407.
DOI: 10.14272/vruybciaejxorz-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C11H11NO4S/c13-12(14)9-1-3-10(4-2-9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, CDCl3], ppm) δ = 8.44–8.39 (m, 2H), 8.08–8.04 (m, 2H), 2.79 (s, 1H), 2.12 (s, 6H).
DOI: 10.14272/vruybciaejxorz-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C11H11NO4S/c13-12(14)9-1-3-10(4-2-9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (100 MHz, CDCl3, ppm) δ = 151.0 (Cq, CArN), 142.9 (Cq, CArS), 130.2 (+, 2x CHAr), 124.4 (+, 2x CHAr), 55.0 (Cq, CCH2), 50.8 (–, 3x CH2), 27.3 (+, CH).
DOI: 10.14272/vruybciaejxorz-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C11H11NO4S/c13-12(14)9-1-3-10(4-2-9)17(15,16)11-5-8(6-11)7-11/h1-4,8H,5-7H2

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3003, 2919, 1524, 1349, 1296, 1285, 1210, 1194, 1170, 1126, 1078, 1014, 941, 881, 854, 778, 747, 732, 684, 619, 575, 548, 452, 407 cm–1.
DOI: 10.14272/igemwxapjbwllg-uhfffaoysa-n.1
title: 1-(phenylsulfinyl)bicyclo[1.1.1]pentane
title: InChI=1S/C11H12OS/c12-13(10-4-2-1-3-5-10)11-6-9(7-11)8-11/h1-5,9H,6-8H2

description: This dataset contains experimental data from a sample (InChI=1S/C11H12OS/c12-13(10-4-2-1-3-5-10)11-6-9(7-11)8-11/h1-5,9H,6-8H2). The datasets from the following experiments are available: 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) mass spectrometry (MS) mass spectrometry (MS) infrared absorption spectroscopy (IR)
DOI: 10.14272/igemwxapjbwllg-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C11H12OS/c12-13(10-4-2-1-3-5-10)11-6-9(7-11)8-11/h1-5,9H,6-8H2

description: dataset for mass spectrometry (MS) EI (m/z, 20 °C): 192 (2) [M]+, 126 (100) [M–C5H7+H]+, 125 (10) [M–C5H7]+, 78 (41) [C6H5+H]+, 77 (15) [C6H5]+, 67 (61) [C5H7]+.
DOI: 10.14272/igemwxapjbwllg-uhfffaoysa-n/chmo0000470.1
title: mass spectrometry (MS) ()
title: InChI=1S/C11H12OS/c12-13(10-4-2-1-3-5-10)11-6-9(7-11)8-11/h1-5,9H,6-8H2

description: dataset for mass spectrometry (MS) HRMS (EI, 20 °C): calcd for C11H12O32S [M]+ 192.0609; found 192.0610.
DOI: 10.14272/igemwxapjbwllg-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C11H12OS/c12-13(10-4-2-1-3-5-10)11-6-9(7-11)8-11/h1-5,9H,6-8H2

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (100 MHz, CDCl3, ppm) δ = 141.7, 130.9, 129.0 (2C), 124.3 (2C), 55.4, 48.9 (3C), 27.8.
DOI: 10.14272/igemwxapjbwllg-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C11H12OS/c12-13(10-4-2-1-3-5-10)11-6-9(7-11)8-11/h1-5,9H,6-8H2

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3461, 2990, 2970, 2917, 2880, 1635, 1476, 1443, 1306, 1201, 1129, 1084, 1067, 1035, 997, 882, 868, 778, 747, 693, 555, 510, 484, 456 cm–1.
DOI: 10.14272/pljoxmuhaaqzqy-uhfffaoysa-n.1
title: S-tert-butyl-S-bicyclo[1.1.1]pentylsulfoximine
title: InChI=1S/C9H17NOS/c1-8(2,3)12(10,11)9-4-7(5-9)6-9/h7,10H,4-6H2,1-3H3

description: This dataset contains experimental data from a sample (InChI=1S/C9H17NOS/c1-8(2,3)12(10,11)9-4-7(5-9)6-9/h7,10H,4-6H2,1-3H3). The datasets from the following experiments are available: infrared absorption spectroscopy (IR) 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) mass spectrometry (MS)
DOI: 10.14272/pljoxmuhaaqzqy-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C9H17NOS/c1-8(2,3)12(10,11)9-4-7(5-9)6-9/h7,10H,4-6H2,1-3H3

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 20 °C): 187 (0.5) [M]+, 67 (100) [C5H7]+, 57 (88) [C4H9]+; HRMS (EI, 20 °C): calc for C9H17NO32S [M]+: 187.1031; found 187.1029.