cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.5586058
title: eeg-workshops/mkpy_data_examples/data

description: EEG data files for eeg-workshops/mkpy_data_examples. For more information see the docs and github source. Updated docs and data files for mkpy v0.2.6, added mkh5 format EEG files with no included epoch tables.
DOI: 10.34703/gzx1-9v95/sixonk
title: ESI-FT-ICR-CASI-CID MS/MS data for the Pantanal SPE-DOM sample

description: The dataset includes MS1 and CASI-CID MS/MS spectra of the SPE-DOM sample Pantanal collected using a Bruker 9T Solarix FT-ICR MS spectrometer.
DOI: 10.34703/gzx1-9v95/sixonk/exuarx
title: ESI_Neg_4MW_PAN_CASI-CID_281-297.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/mwd3xo
title: ESI_Neg_4MW_PAN_CASI-CID_261.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/ibrnrg
title: ESI_Neg_4MW_PAN_CASI-CID_465-467.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/l5affk
title: ESI_Neg_4MW_PAN_CASI-CID_387-401.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/vycgkn
title: ESI_Neg_4MW_PAN_CASI-CID_263-279.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/zxzggo
title: ESI_Neg_4MW_PAN_CASI-CID_299-313.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/obvdq3
title: ESI_Neg_4MW_PAN_CASI-CID_401-419.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/rk3xrm
title: ESI_Neg_4MW_PAN_CASI-CID_375-379.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/rulgvm
title: ESI_Neg_4MW_PAN_CASI-CID_343-357.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/j9bec3
title: ESI_Neg_4MW_PAN_CASI-CID_329-343.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/uoihhv
title: ESI_Neg_4MW_PAN_CASI-CID_381-399.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/eg9xh4
title: ESI_Neg_4MW_PAN_CASI-CID_445-463.d.zip

description: :unav
DOI: 10.14272/jlppehszlkooov-uhfffaoysa-n.1
title: C22H24N2O6S2
title: InChI=1S/C22H24N2O6S2/c1-5-27-17-15(21(25)29-7-3)31-19(23-17)13-10-9-11-14(12-13)20-24-18(28-6-2)16(32-20)22(26)30-8-4/h9-12H,5-8H2,1-4H3

description: This dataset contains experimental data from a sample (InChI=1S/C22H24N2O6S2/c1-5-27-17-15(21(25)29-7-3)31-19(23-17)13-10-9-11-14(12-13)20-24-18(28-6-2)16(32-20)22(26)30-8-4/h9-12H,5-8H2,1-4H3). 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: 10.34703/gzx1-9v95/sixonk/wqsn1v
title: ESI_Neg_4MW_PAN_CASI-CID_421-425.d.zip

description: :unav
DOI: 10.14272/jlppehszlkooov-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C22H24N2O6S2/c1-5-27-17-15(21(25)29-7-3)31-19(23-17)13-10-9-11-14(12-13)20-24-18(28-6-2)16(32-20)22(26)30-8-4/h9-12H,5-8H2,1-4H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ, cm–1), 2982.4 (w), 1709.6 (vs), 1679.7 (s), 1528.3 (vs), 1472.4 (w), 1374.0 (vs), 1348.0 (s), 1252.5 (vs), 1170.6 (w), 1081.9 (vs), 1015.3 (m), 892.9 (w), 863.0 (w), 808.0 (m), 756.0 (s), 698.1 (w), 680.7 (s).
DOI: 10.14272/jlppehszlkooov-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C22H24N2O6S2/c1-5-27-17-15(21(25)29-7-3)31-19(23-17)13-10-9-11-14(12-13)20-24-18(28-6-2)16(32-20)22(26)30-8-4/h9-12H,5-8H2,1-4H3

description: dataset for mass spectrometry (MS) MS (ESI), m/z (%): 477.12 (M+H)+, 499.10 (M+Na)+.
DOI: 10.34703/gzx1-9v95/sixonk/ap6hce
title: ESI_Neg_4MW_PAN_CASI-CID_313-327.d.zip

description: :unav
DOI: 10.14272/jlppehszlkooov-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C22H24N2O6S2/c1-5-27-17-15(21(25)29-7-3)31-19(23-17)13-10-9-11-14(12-13)20-24-18(28-6-2)16(32-20)22(26)30-8-4/h9-12H,5-8H2,1-4H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (300 MHz, DMSO-d6, ppm) δ = 8.26 (t, J = 1.61 Hz, 1H), 8.01 (dd, J1 = 7.83 Hz, J2 = 1.77, 2H), 7.58 (t, J = 7.83 Hz, 1H), 4.54 (q, J = 14.04 Hz, 4H), 4.22 (q, J = 14.16 Hz, 4H), 1.40 (t, J = 7.02 Hz, 6H), 1.28 (t, J = 7.08 Hz, 6H).
DOI: 10.34703/gzx1-9v95/sixonk/kcoggy
title: ESI_Neg_4MW_PAN_CASI-CID_469-483.d.zip

description: :unav
DOI: 10.14272/jlppehszlkooov-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C22H24N2O6S2/c1-5-27-17-15(21(25)29-7-3)31-19(23-17)13-10-9-11-14(12-13)20-24-18(28-6-2)16(32-20)22(26)30-8-4/h9-12H,5-8H2,1-4H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (75,5 MHz, DMSO-d6, ppm) δ = 166.0, 166.0, 165.4, 165.4, 160.7, 160.7, 133.6, 133.6, 131.0, 129.3, 129.3, 123.4, 101.9, 101.9, 67.2, 67.2, 60.9, 60.9, 15.2, 15.2, 15.7, 15.7.
DOI: 10.34703/gzx1-9v95/sixonk/gycrmf
title: ESI_Neg_4MW_PAN_CASI-CID_425-443.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/lkcd29
title: ESI_Neg_4MW_PAN_CASI-CID_359-373.d.zip

description: :unav
DOI: 10.34703/gzx1-9v95/sixonk/xd8yka
title: ESI_Neg_4MW_PAN_MS1.d.zip

description: :unav
DOI: 10.5281/zenodo.5585152
title: Synthetic ground motions to support the Fennoscandian GMPEs. Supporting information – Response spectra dataset in excel format

description: This dataset has been created in the NKS project: ”Synthetic ground motions to support the Fennoscandian GMPEs”, contract: NKS-R(18)126/5. The data is RotD50 (Boore, 2010, doi: 10.1785/0120090400), pseudo-acceleration response spectra calculated from synthetic ground motions generated using physics-based modeling of Fennoscandian earthquakes. The earthquake magnitude range is 4.3-5.6; the rupture distance range 2-30km and the hypocenter depth range 2-20km. The response spectra is in mm/s2 and should be used up to 25Hz. Cite the data as part of the research report: Fülöp, L., Jussila, V., Fälth, B., Voss, P., Lund, B. 2019. Synthetic ground motions to support the Fennoscandian GMPEs. NKS - Nordic Nuclear Safety Research NKS-424, ISBN: ISBN 978-87-7893-514-4 Methods used to generate the data are described in: Fülöp, L., Jussila, V., Lund, B., Fälth, B., Voss, P., Puttonen, J., Saari, J., and Heikkinen, P. 2017. Modelling as a Tool to Augment Ground Motion Data in Regions of Diffuse Seismicity – Final report. NKS - Nordic Nuclear Safety Research NKS-394, ISBN: 978-87-7893-482-6 Fülöp, L., Jussila, V., Lund, B., Fälth, B., Voss, P., Puttonen, J., Saari, J., 2016. Modelling as a tool to augment ground motion data in regions of diffuse seismicity - Progress 2015. NKS Nordic Nuclear Safety Research, ISBN: 978-87-7893-448-2
description: Funding from: Nordic Nuclear Safety Research, Project NKS-R(18)126/5
DOI: 10.5281/zenodo.5585151
title: Synthetic ground motions to support the Fennoscandian GMPEs. Supporting information – Response spectra dataset in excel format

description: This dataset has been created in the NKS project: ”Synthetic ground motions to support the Fennoscandian GMPEs”, contract: NKS-R(18)126/5. The data is RotD50 (Boore, 2010, doi: 10.1785/0120090400), pseudo-acceleration response spectra calculated from synthetic ground motions generated using physics-based modeling of Fennoscandian earthquakes. The earthquake magnitude range is 4.3-5.6; the rupture distance range 2-30km and the hypocenter depth range 2-20km. The response spectra is in mm/s2 and should be used up to 25Hz. Cite the data as part of the research report: Fülöp, L., Jussila, V., Fälth, B., Voss, P., Lund, B. 2019. Synthetic ground motions to support the Fennoscandian GMPEs. NKS - Nordic Nuclear Safety Research NKS-424, ISBN: ISBN 978-87-7893-514-4 Methods used to generate the data are described in: Fülöp, L., Jussila, V., Lund, B., Fälth, B., Voss, P., Puttonen, J., Saari, J., and Heikkinen, P. 2017. Modelling as a Tool to Augment Ground Motion Data in Regions of Diffuse Seismicity – Final report. NKS - Nordic Nuclear Safety Research NKS-394, ISBN: 978-87-7893-482-6 Fülöp, L., Jussila, V., Lund, B., Fälth, B., Voss, P., Puttonen, J., Saari, J., 2016. Modelling as a tool to augment ground motion data in regions of diffuse seismicity - Progress 2015. NKS Nordic Nuclear Safety Research, ISBN: 978-87-7893-448-2
description: Funding from: Nordic Nuclear Safety Research, Project NKS-R(18)126/5
DOI: 10.3886/e151621v1
title: National Health and Nutrition Examination Survey (NHANES) for Dementia Researchers, 2011-2014

description: This repository represents a series of code and corresponding data files intended for use in cognitive decline and Alzheimer’s disease and related dementias (ADRD) research. The files include three datasets derived from the 2011-12 and 2013-14 National Health and Nutrition Examination Survey (NHANES) panels (survey years 2011-12, 2013-14, and 2-year appended data file). NHANES is a nationally representative program of studies that, among many other things, allows researchers to assess the health of adults in the United States. <br><br>The provided datasets include sociodemographic information on respondents’ age, sex, race, and education levels merged onto individual and summary cognition variables generated from 1) the word learning and recall modules from the Consortium to Establish a Registry for Alzheimer's Disease neuropathology protocol (CERAD), 2) the Animal Fluency test, and 3) the Digit Symbol Substitution test (DSST). Cognition variables were then standardized on relevant sociodemographic characteristics (education, race, and age). Brief and detailed summaries of the variables available in these datasets along with more detailed descriptions of performed calculations can be found in the provided data dictionaries. SAS, Stata, and CSV file formats are provided as are the full coding scripts used in both SAS and Stata.<br>
description: Users of this resource should be familiar with complex survey design and appropriately apply the sample weights, strata, and cluster/primary sampling unit for any analyses. While both the exam and interview weights are provided, MEC exam weight (wtmec2yr) should be used for all analyses including cognition data. Interview weight (wtint2yr) has been included for those who wish to add interview datasets to the provided data. Strata should be set to the Masked variable pseudo-stratum (sdmvstra) and cluster/PSU should be set to the Masked variance pseudo-PSU (sdmvpsu).
description: Response Rates: See NHANES website for more information.
description: Presence of Common Scales: 1) the word learning and recall modules from the Consortium to Establish a Registry for Alzheimer's Disease neuropathology protocol (CERAD), 2) the Animal Fluency test, and 3) the Digit Symbol Substitution test (DSST)
description: Complex survey data with a stratified, clustered sampling design. Oversampling of Hispanic, Black, and Asian persons.
description: Nationally representative sample of noninstitutionalized U.S. civilians of all ages. Cognition data only available for older U.S. adults (age 60 and above). Smallest Geographic Unit: U.S.
description: cognitive assessment test; face-to-face interview; mixed mode; on-site questionnaire; Only those age 60 and above were asked the cognition questions (e.g., CERAD). While both the MEC exam and interview weights are provided, <b>the</b> <b>MEC exam weight (</b><b>wtmec2yr</b><b>) should be used for all analyses including cognition data</b>. Interview weight provided for those who wish to add interview datasets to the provided data.
DOI: 10.3886/e149921
title: Data and Code for: The Causal Effects of Place on Health and Longevity

description: Life expectancy varies substantially across local regions within a country, raising conjectures that place of residence affects health. However, population sorting and other confounders make it difficult to disentangle the effects of place on health from other geographic differences in life expectancy. Recent studies have overcome such challenges to demonstrate that place of residence substantially influences health and mortality. Whether policies that encourage people to move to places that are better for their health or that improve areas that are detrimental to health are desirable depends on the mechanisms behind place effects, yet these mechanisms remain poorly understood. <b>This repository contains data and code accompanying the article.</b><br>
DOI: 10.3886/e149921v1
title: Data and Code for: The Causal Effects of Place on Health and Longevity

description: Life expectancy varies substantially across local regions within a country, raising conjectures that place of residence affects health. However, population sorting and other confounders make it difficult to disentangle the effects of place on health from other geographic differences in life expectancy. Recent studies have overcome such challenges to demonstrate that place of residence substantially influences health and mortality. Whether policies that encourage people to move to places that are better for their health or that improve areas that are detrimental to health are desirable depends on the mechanisms behind place effects, yet these mechanisms remain poorly understood. <b>This repository contains data and code accompanying the article.</b><br>
DOI: 10.5517/ccdc.csd.cc26tlzm
title: CCDC 2050401: Experimental Crystal Structure Determination

description: Related Article: Ravi Yadav, Martin Weber, Akhil K. Singh, Luca Münzfeld, Johannes Gramüller, Ruth M. Gschwind, Manfred Scheer, Peter W. Roesky|2021|Chem.-Eur.J.|27|14128|doi:10.1002/chem.202102355
DOI: 10.5517/ccdc.csd.cc26tm0p
title: CCDC 2050402: Experimental Crystal Structure Determination

description: Related Article: Ravi Yadav, Martin Weber, Akhil K. Singh, Luca Münzfeld, Johannes Gramüller, Ruth M. Gschwind, Manfred Scheer, Peter W. Roesky|2021|Chem.-Eur.J.|27|14128|doi:10.1002/chem.202102355
DOI: 10.5517/ccdc.csd.cc26tm1q
title: CCDC 2050403: Experimental Crystal Structure Determination

description: Related Article: Ravi Yadav, Martin Weber, Akhil K. Singh, Luca Münzfeld, Johannes Gramüller, Ruth M. Gschwind, Manfred Scheer, Peter W. Roesky|2021|Chem.-Eur.J.|27|14128|doi:10.1002/chem.202102355
DOI: 10.5517/ccdc.csd.cc26tm2r
title: CCDC 2050404: Experimental Crystal Structure Determination

description: Related Article: Ravi Yadav, Martin Weber, Akhil K. Singh, Luca Münzfeld, Johannes Gramüller, Ruth M. Gschwind, Manfred Scheer, Peter W. Roesky|2021|Chem.-Eur.J.|27|14128|doi:10.1002/chem.202102355
DOI: 10.5517/ccdc.csd.cc26tm3s
title: CCDC 2050405: Experimental Crystal Structure Determination

description: Related Article: Ravi Yadav, Martin Weber, Akhil K. Singh, Luca Münzfeld, Johannes Gramüller, Ruth M. Gschwind, Manfred Scheer, Peter W. Roesky|2021|Chem.-Eur.J.|27|14128|doi:10.1002/chem.202102355
DOI: 10.14272/hxxwhzsncalsil-uhfffaoysa-n.1
title: C17H15N3O6S2
title: InChI=1S/C17H15N3O6S2/c1-3-25-16(23)10-12(21)19-14(27-10)8-6-5-7-9(18-8)15-20-13(22)11(28-15)17(24)26-4-2/h5-7,21-22H,3-4H2,1-2H3

description: This dataset contains experimental data from a sample (InChI=1S/C17H15N3O6S2/c1-3-25-16(23)10-12(21)19-14(27-10)8-6-5-7-9(18-8)15-20-13(22)11(28-15)17(24)26-4-2/h5-7,21-22H,3-4H2,1-2H3). 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)
DOI: 10.14272/hxxwhzsncalsil-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C17H15N3O6S2/c1-3-25-16(23)10-12(21)19-14(27-10)8-6-5-7-9(18-8)15-20-13(22)11(28-15)17(24)26-4-2/h5-7,21-22H,3-4H2,1-2H3

description: dataset for mass spectrometry (MS) MS (ESI), m/z (%): 422.05 (M+H)+, 444.03 (M+Na)+, 865.97 (2M+Na)+.
DOI: 10.14272/hxxwhzsncalsil-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C17H15N3O6S2/c1-3-25-16(23)10-12(21)19-14(27-10)8-6-5-7-9(18-8)15-20-13(22)11(28-15)17(24)26-4-2/h5-7,21-22H,3-4H2,1-2H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (300 MHz, DMSO-d6, ppm) δ = 12.28 (s, 2H), 8.16 (m, 3H), 4.28 (q, J = 14.16 Hz, 4H), 1.31 (t, J = 7.08 Hz, 6H).
DOI: 10.14272/hxxwhzsncalsil-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C17H15N3O6S2/c1-3-25-16(23)10-12(21)19-14(27-10)8-6-5-7-9(18-8)15-20-13(22)11(28-15)17(24)26-4-2/h5-7,21-22H,3-4H2,1-2H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (75,5 MHz, DMSO-d6, ppm) δ = 166.7, 166.7, 166.3, 166.3, 161.8, 161.8, 149.8, 149.8, 140.5, 121.9, 121.9, 101.2, 101.2, 61.0, 61.0, 14.8, 14.8.
DOI: 10.6073/pasta/f01382fcc95d02f86c8182202542ce7e
title: Monthly precipitation data from a network of standard gauges at the Jornada Experimental Range (Jornada Basin LTER) in southern New Mexico, January 1916 - ongoing

description: This ongoing dataset contains monthly precipitation measurements from a network of standard can rain gauges at the Jornada Experimental Range in Dona Ana County, New Mexico, USA. Precipitation physically collects within gauges during the month and is manually measured with a graduated cylinder at the end of each month. This network is maintained by USDA Agricultural Research Service personnel. This dataset includes 39 different locations but only 29 of them are current. Other precipitation data exist for this area, including event-based tipping bucket data with timestamps, but do not go as far back in time as this dataset.
DOI: 10.14272/jrvajrfyxdelkj-uhfffaoysa-n.1
title: C12H11NO2S
title: InChI=1S/C12H11NO2S/c1-2-15-11-10(8-14)16-12(13-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3

description: This dataset contains experimental data from a sample (InChI=1S/C12H11NO2S/c1-2-15-11-10(8-14)16-12(13-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3). 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) distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/jrvajrfyxdelkj-uhfffaoysa-n/chmo0000596
title: distortionless enhancement with polarization transfer (DEPT) ()
title: InChI=1S/C12H11NO2S/c1-2-15-11-10(8-14)16-12(13-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3

description: dataset for distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/jrvajrfyxdelkj-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C12H11NO2S/c1-2-15-11-10(8-14)16-12(13-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (300 MHZ, DMSO-d6, ppm) δ = 9.85 (s, 1H), 8.02–8.00 (m, 2H), 7.59–7.54 (m, 3H), 4.63 (q, J = 7.04 Hz, 2H), 1.42 (t, J = 7.02 Hz, 3H).
DOI: 10.14272/jrvajrfyxdelkj-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C12H11NO2S/c1-2-15-11-10(8-14)16-12(13-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3

description: dataset for mass spectrometry (MS) MS (ESI), m/z (%): 236.08 (M+H)+, 256.04 (M+H)+.
DOI: 10.14272/jrvajrfyxdelkj-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C12H11NO2S/c1-2-15-11-10(8-14)16-12(13-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ): 3050.8 (w), 2975.6 (w), 2858.0 (w), 1646.0 (vs), 1522.5 (vs), 1483.0 (m), 1428.0 (w), 1403.9 (s), 1381.8 (s), 1347.03 (vs), 1250.6 (m), 1225.5 (m), 1181.2 (m), 1106.9 (vs), 1011.5 (s), 966.2 (m), 924.7 (w), 866.8 (m), 815.7 (w), 762.7 (s), 710.6 (s), 675.9 (vs) cm–1.
DOI: 10.14272/jrvajrfyxdelkj-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C12H11NO2S/c1-2-15-11-10(8-14)16-12(13-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (75 MHz, DMSO-d6, ppm) δ = 180.9, 171.9 (q), 168.1 (q), 132.9, 132.3 (q), 129.9, 129.9, 127.0, 127.0, 112.5 (q), 67.6, 15.2.
DOI: 10.14272/biiughhbwieknk-uhfffaoysa-n.1
title: C10H8ClNS
title: InChI=1S/C10H8ClNS/c1-7-9(11)12-10(13-7)8-5-3-2-4-6-8/h2-6H,1H3

description: This dataset contains experimental data from a sample (4-chloro-5-methyl-2-phenyl-1,3-thiazole, InChI=1S/C10H8ClNS/c1-7-9(11)12-10(13-7)8-5-3-2-4-6-8/h2-6H,1H3). 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/biiughhbwieknk-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (4-chloro-5-methyl-2-phenyl-1,3-thiazole)
title: InChI=1S/C10H8ClNS/c1-7-9(11)12-10(13-7)8-5-3-2-4-6-8/h2-6H,1H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 2920.7 (w), 1956.4 (w), 1578.5 (w), 1517.7 (s), 1496.5 (m), 1457.0 (s), 1331.6 (w), 1311.4 (w), 1289.2 (w), 1263.2 (s), 1223.6 (vs), 1160.0 (w), 1074.2 (w), 1041.4 (s), 999.9 (m), 973.9 (vs), 909.3 (w), 840.8 (w), 823.5 (m), 760.0 (vs), 713.5 (m), 595.0 (vs) cm–1.
DOI: 10.14272/biiughhbwieknk-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (4-chloro-5-methyl-2-phenyl-1,3-thiazole)
title: InChI=1S/C10H8ClNS/c1-7-9(11)12-10(13-7)8-5-3-2-4-6-8/h2-6H,1H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (300 MHz, DMSO-d6, ppm) δ = 7.87–7.84 (m, 2H), 7.50 (t, J = 3.2 Hz, 3H), 2.41 (s, 3H).
DOI: 10.14272/biiughhbwieknk-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (4-chloro-5-methyl-2-phenyl-1,3-thiazole)
title: InChI=1S/C10H8ClNS/c1-7-9(11)12-10(13-7)8-5-3-2-4-6-8/h2-6H,1H3

description: dataset for mass spectrometry (MS) MS (ESI), m/z (%): 210.02 (M+H)+; 212.01 (M+H)+
DOI: 10.14272/biiughhbwieknk-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (4-chloro-5-methyl-2-phenyl-1,3-thiazole)
title: InChI=1S/C10H8ClNS/c1-7-9(11)12-10(13-7)8-5-3-2-4-6-8/h2-6H,1H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (75 MHz, DMSO-d6, ppm) δ = 163.8 (q), 136.5 (q), 132.6 (q), 131.1, 129.8, 129.8, 127.3, 126.0, 126.0, 11.7
DOI: 10.14272/vqnxtbfbrgtadb-uhfffaoysa-n.1
title: C18H16N2O6S2
title: InChI=1S/C18H16N2O6S2/c1-3-25-17(23)11-13(21)19-15(27-11)9-6-5-7-10(8-9)16-20-14(22)12(28-16)18(24)26-4-2/h5-8,21-22H,3-4H2,1-2H3

description: This dataset contains experimental data from a sample (InChI=1S/C18H16N2O6S2/c1-3-25-17(23)11-13(21)19-15(27-11)9-6-5-7-10(8-9)16-20-14(22)12(28-16)18(24)26-4-2/h5-8,21-22H,3-4H2,1-2H3). 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/vqnxtbfbrgtadb-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C18H16N2O6S2/c1-3-25-17(23)11-13(21)19-15(27-11)9-6-5-7-10(8-9)16-20-14(22)12(28-16)18(24)26-4-2/h5-8,21-22H,3-4H2,1-2H3

description: dataset for mass spectrometry (MS) MS (ESI), m/z (%): 421.05 (M+H)+, 443.03 (M+Na)+, 841.10 (2M+H)+, 863.03 (2M+Na)+
DOI: 10.14272/vqnxtbfbrgtadb-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C18H16N2O6S2/c1-3-25-17(23)11-13(21)19-15(27-11)9-6-5-7-10(8-9)16-20-14(22)12(28-16)18(24)26-4-2/h5-8,21-22H,3-4H2,1-2H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (75 MHz, DMSO-d6, ppm) δ = 166.2, 166.2, 166.1, 166.1, 161.6, 161.6, 133.3, 133.3, 131.1, 129.1, 129.1, 123.3, 98.9, 98.9, 60.9, 60.9, 14.7, 14.7.
DOI: 10.14272/vqnxtbfbrgtadb-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C18H16N2O6S2/c1-3-25-17(23)11-13(21)19-15(27-11)9-6-5-7-10(8-9)16-20-14(22)12(28-16)18(24)26-4-2/h5-8,21-22H,3-4H2,1-2H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ, cm–1), 2984.3 (w), 1646.9 (vs), 1535.1 (vs), 1498.4 (w), 1473.4 (w), 1403.9 (vs), 1376.0 (s), 1339.3 (s), 1264.1 (s), 1203.4 (vs), 1114.7 (s), 1083.6 (s), 1015.3 (m), 948.8 (w), 925.7 (m), 795.5 (s), 764.6 (vs), 742.5 (m), 684.6 (vs).