cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.14272/htuxsvmuhumuto-htapyjjxsa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C22H17IO3/c1-13-10-11-22(21(26)16-8-4-5-9-18(16)23)17(12-13)19(24)14-6-2-3-7-15(14)20(22)25/h2-10,17H,11-12H2,1H3/t17-,22+/m0/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, CDCl3, ppm) δ = 8.15 (dd, 3J = 7.6 Hz, 4J = 1.5 Hz, 1H, CHAr), 8.02 (dd, 3J = 7.6 Hz, 4J = 1.5 Hz, 1H, CHAr), 7.86 (dd, 3J = 8.0 Hz, 4J = 1.6 Hz, 1H, CHAr), 7.75 (dtd, J = 21.0 Hz, 3J = 7.4 Hz, 4J = 1.5 Hz, 2H, CHAr), 7.36–7.25 (m, 1H, CHAr), 7.16 (dd, 3J = 7.7 Hz, 4J = 1.7 Hz, 1H, CHAr), 7.07 (td, 3J = 7.7 Hz, 4J = 1.7 Hz, 1H, CHAr), 5.34 (ddd, 3J = 4.8, 3.3 Hz, 4J = 1.6 Hz, 1H, C=CH), 3.72 (dd, 3J = 8.4, 7.1 Hz, 1H, CH), 2.90 (ddq, 2J = 17.5 , 3J = 3.9 Hz, 4J = 1.9 Hz, 1H, CHH), 2.46 (dq, 2J = 17.5 Hz, 3J = 2.3 Hz, 1H, CHH), 2.25 (d, 3J = 7.4 Hz, 2H, CH2), 1.65 (s, 3H, CH3). Impurities: spectrum contains signals of ethyl acetate at 2.05 and 1.26 ppm and the other regioisomer.
DOI: 10.14272/htuxsvmuhumuto-htapyjjxsa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C22H17IO3/c1-13-10-11-22(21(26)16-8-4-5-9-18(16)23)17(12-13)19(24)14-6-2-3-7-15(14)20(22)25/h2-10,17H,11-12H2,1H3/t17-,22+/m0/s1

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ): 2910 (vw), 1676 (m), 1592 (w), 1423 (w), 1317 (vw), 1273 (w), 1253 (w), 1218 (w), 1161 (vw), 1061 (vw), 1010 (w), 967 (vw), 936 (w), 897 (vw), 794 (w), 761 (w), 738 (w), 677 (w), 637 (vw), 588 (w), 519 (vw), 430 (vw) cm–1
DOI: 10.14272/issavwgyauzpds-uhfffaoysa-n.1
title: C20H17BrO4
title: InChI=1S/C20H17BrO4/c1-23-12-8-9-17(21)15(10-12)19(22)16-11-18(24-2)13-6-4-5-7-14(13)20(16)25-3/h4-11H,1-3H3

description: This dataset contains experimental data from a sample (InChI=1S/C20H17BrO4/c1-23-12-8-9-17(21)15(10-12)19(22)16-11-18(24-2)13-6-4-5-7-14(13)20(16)25-3/h4-11H,1-3H3). The datasets from the following experiments are available: infrared absorption spectroscopy (IR) atmospheric pressure chemical ionisation mass spectrometry (APCI MS) 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/issavwgyauzpds-uhfffaoysa-n/chmo0000473
title: atmospheric pressure chemical ionisation mass spectrometry (APCI MS) ()
title: InChI=1S/C20H17BrO4/c1-23-12-8-9-17(21)15(10-12)19(22)16-11-18(24-2)13-6-4-5-7-14(13)20(16)25-3/h4-11H,1-3H3

description: dataset for atmospheric pressure chemical ionisation mass spectrometry (APCI MS) APCI (m/z): 401/403 (100/100) [M+H]+. – HRMS-APCI (m/z) calcd for C20H18BrO4, 401.0388; found, 401.0374.
DOI: 10.14272/issavwgyauzpds-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C20H17BrO4/c1-23-12-8-9-17(21)15(10-12)19(22)16-11-18(24-2)13-6-4-5-7-14(13)20(16)25-3/h4-11H,1-3H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, CDCl3, ppm) δ = 8.32–8.26 (m, 1H, CHAr), 8.13–8.07 (m, 1H, CHAr), 7.64–7.55 (m, 2H, CHAr), 7.52 (d, 3J = 8.8 Hz, 1H, CHAr), 7.09 (s, 1H, CHAr), 7.00 (d, 4J = 3.0 Hz, 1H, CHAr), 6.90 (dd, 3J = 8.7 Hz, 4J = 3.0 Hz, 1H, CHAr), 4.03 (s, 3H, OCH3), 3.79 (s, 3H, OCH3), 3.67 (s, 3H, OCH3).Impurities: spectrum contains water signal at 1.56 ppm and grease signal at 0.07 ppm.
DOI: 10.14272/issavwgyauzpds-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C20H17BrO4/c1-23-12-8-9-17(21)15(10-12)19(22)16-11-18(24-2)13-6-4-5-7-14(13)20(16)25-3/h4-11H,1-3H3

description: dataset for infrared absorption spectroscopy (IR) – IR (ATR): ṽ = 2935 (w), 2838 (w), 1650 (m), 1620 (m), 1592 (m), 1568 (m), 1458 (m), 1404 (m), 1366 (s), 1310 (m), 1281 (m), 1214 (s), 1162 (m), 1113 (m), 1094 (s), 1057 (m), 1020 (m), 962 (m), 853 (m), 813 (m), 767 (s), 709 (m), 669 (m), 603 (m), 486 (w), 430 (w) cm-1.
DOI: 10.15468/bavxg4
title: The cephalopods of the Boda Limestone, Late Ordovician, of Dalarna, Sweden

description: This dataset contains the digitized treatments in Plazi based on the original journal article Kröger, Björn (2013): The cephalopods of the Boda Limestone, Late Ordovician, of Dalarna, Sweden. European Journal of Taxonomy 41: 1-110, DOI: http://dx.doi.org/10.5852/ejt.2013.41
DOI: 10.14272/issavwgyauzpds-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C20H17BrO4/c1-23-12-8-9-17(21)15(10-12)19(22)16-11-18(24-2)13-6-4-5-7-14(13)20(16)25-3/h4-11H,1-3H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (101 MHz, CDCl3, ppm) δ = 195.5 (Cq, 1 × C=O), 158.8 (Cq, 1 × CqAr), 152.4 (Cq, 1 × CqAr), 152.1 (Cq, 1 × CqAr), 143.4 (Cq, 1 × CqAr), 134.1 (+, 1 × CHAr), 129.6 (Cq, 1 × CqAr), 128.8 (Cq, 1 × CqAr), 128.3 (+, 1 × CHAr), 127.3 (+, 1 × CHAr), 126.2 (Cq, 1 × CqAr), 123.7 (+, 1 × CHAr), 122.8 (+, 1 × CHAr), 117.5 (+, 1 × CHAr), 114.9 (+, 1 × CHAr), 110.2 (Cq, 1 × CqAr), 103.0 (+, 1 × CHAr), 64.1 (+, 1 × OCH3), 56.0 (+, 1 × OCH3), 55.8 (+, 1 × OCH3).
DOI: 10.14272/mwupabmfgfihkp-uhfffaoysa-n.1
title: C19H12BrNO4
title: InChI=1S/C19H12BrNO4/c1-10(22)21-11-6-7-16(20)14(8-11)19(25)15-9-17(23)12-4-2-3-5-13(12)18(15)24/h2-9H,1H3,(H,21,22)

description: This dataset contains experimental data from a sample (InChI=1S/C19H12BrNO4/c1-10(22)21-11-6-7-16(20)14(8-11)19(25)15-9-17(23)12-4-2-3-5-13(12)18(15)24/h2-9H,1H3,(H,21,22)). The datasets from the following experiments are available: 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) fast-atom bombardment mass spectrometry (FABMS) infrared absorption spectroscopy (IR)
DOI: 10.14272/mwupabmfgfihkp-uhfffaoysa-n/chmo0000563
title: fast-atom bombardment mass spectrometry (FABMS) ()
title: InChI=1S/C19H12BrNO4/c1-10(22)21-11-6-7-16(20)14(8-11)19(25)15-9-17(23)12-4-2-3-5-13(12)18(15)24/h2-9H,1H3,(H,21,22)

description: dataset for fast-atom bombardment mass spectrometry (FABMS) FAB (m/z, 3-NBA): 398 (5) [M+H]+, 307 (35), 154 (100); – HRMS-FAB (m/z): [M+H]+ calcd for C19H13O4N79Br, calc. 398.0028; found, 398.0027.
DOI: 10.14272/mwupabmfgfihkp-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C19H12BrNO4/c1-10(22)21-11-6-7-16(20)14(8-11)19(25)15-9-17(23)12-4-2-3-5-13(12)18(15)24/h2-9H,1H3,(H,21,22)

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.14-8.07 (m, 2H, CHAr), 7.84-7.80 (m, 3H, CHAr), 7.69 (d, 4J = 2.7 Hz, 1H, CHAr), 7.53 (d, 3J = 8.8 Hz, 1H, CHAr), 7.51 (brs, 1H, NH), 7.18 (s, 1H, C=CH), 2.19 (s, 3H, COCH3). Impurities: spectrum contains grease signal at 0.07 ppm.
DOI: 10.14272/mwupabmfgfihkp-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C19H12BrNO4/c1-10(22)21-11-6-7-16(20)14(8-11)19(25)15-9-17(23)12-4-2-3-5-13(12)18(15)24/h2-9H,1H3,(H,21,22)

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (126 MHz, CDCl3, ppm) δ = 192.3 (Cq, 1 × C=O), 185.0 (Cq, 1 × C=O), 182.7 (Cq, 1 × C=O), 168.7 (Cq, 1 × C=O), 145.7 (Cq, 1 × CqAr), 139.2 (Cq, 1 × CqAr), 138.1 (Cq, 1 × CqAr), 137.5 (+, 1 × CHAr), 134.8 (+, 1 × CHAr), 134.6 (+, 1 × CHAr), 134.5 (+, 1 × CHAr), 132.2 (Cq, 1 × CqAr), 131.8 (Cq, 1 × CqAr), 127.1 (+, 1 × CHAr), 126.6 (+, 1 × CHAr), 124.7 (+, 1 × CHAr), 121.7 (+, 1 × CHAr), 114.9 (Cq, 1 × Cq), 24.8 (+, 1 × COCH3). Impurities: Spectrum contains unknown impurity at 27 ppm.
DOI: 10.14272/mwupabmfgfihkp-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C19H12BrNO4/c1-10(22)21-11-6-7-16(20)14(8-11)19(25)15-9-17(23)12-4-2-3-5-13(12)18(15)24/h2-9H,1H3,(H,21,22)

description: dataset for infrared absorption spectroscopy (IR) IR (ATR): ṽ = 3367 (vw), 2926 (vw), 1654 (w), 1581 (w), 1530 (w), 1466 (w), 1392 (w), 1295 (w), 1250 (w), 1233 (w), 1099 (vw), 1046 (vw), 1013 (w), 892 (vw), 826 (vw), 776 (w), 758 (w), 723 (vw), 661 (vw), 574 (vw), 487 (vw), 416 (vw) cm-1.
DOI: 10.5281/zenodo.3813509
title: Subset of nucleosomal DNA sequences from mouse brain nucleus accumbens tissue (GEO dataset GSE54263)

description: This dataset contains a subset of nucleosomal DNA sequences of +1 nucleosomes from mouse brain nucleus accumbens cells (NAC) used to analyze nucleosome positioning sequence (NPS) patterns in Pranckeviciene, Erinija and Hosid, Sergey and Liang, Nathan and Ioshikhes, Ilya (2020). Nucleosome positioning sequence patterns as packing or regulatory. In PLoS computational biology, 16 (1), pp. e1007365. controlm.fa.gz contains sequences of <strong>control</strong> mice (GSE54263 subset Con_H3 GSM1311267) resilientm.fa.gz contains sequences of mice <strong>resilient to social stress</strong> (GSE54263 subset Res_H3 GSM1311268) susceptiblem.fa.gz contains sequences of<strong> </strong>mice <strong>susceptible to social stress</strong> (GSE54263 subset Sus_H3 GSM1311269) This dataset originates from the GEO accession GSE54263 data from Sun H, Damez-Werno DM, Scobie KN, Shao NY et al. ACF chromatin-remodeling complex mediates stress-induced depressive-like behavior. <em>Nat Med</em> 2015 Oct;21(10):1146-53.
description: {"references": ["Pranckeviciene E, Hosid S, Liang N, Ioshikhes I (2020) Nucleosome positioning sequence patterns as packing or regulatory. PLoS Comput Biol 16(1): e1007365."]}
DOI: 10.5281/zenodo.3813510
title: Subset of nucleosomal DNA sequences from mouse brain nucleus accumbens tissue (GEO dataset GSE54263)

description: This dataset contains a subset of nucleosomal DNA sequences of +1 nucleosomes from mouse brain nucleus accumbens cells (NAC) used to analyze nucleosome positioning sequence (NPS) patterns in Pranckeviciene, Erinija and Hosid, Sergey and Liang, Nathan and Ioshikhes, Ilya (2020). Nucleosome positioning sequence patterns as packing or regulatory. In PLoS computational biology, 16 (1), pp. e1007365. controlm.fa.gz contains sequences of <strong>control</strong> mice (GSE54263 subset Con_H3 GSM1311267) resilientm.fa.gz contains sequences of mice <strong>resilient to social stress</strong> (GSE54263 subset Res_H3 GSM1311268) susceptiblem.fa.gz contains sequences of<strong> </strong>mice <strong>susceptible to social stress</strong> (GSE54263 subset Sus_H3 GSM1311269) This dataset originates from the GEO accession GSE54263 data from Sun H, Damez-Werno DM, Scobie KN, Shao NY et al. ACF chromatin-remodeling complex mediates stress-induced depressive-like behavior. <em>Nat Med</em> 2015 Oct;21(10):1146-53.
description: {"references": ["Pranckeviciene E, Hosid S, Liang N, Ioshikhes I (2020) Nucleosome positioning sequence patterns as packing or regulatory. PLoS Comput Biol 16(1): e1007365."]}
DOI: 10.14272/fdosukyerhqqqo-uhfffaoysa-n.1
title: C25H23BrO5
title: InChI=1S/C25H23BrO5/c1-13-9-18-22(27)15-7-5-6-8-16(15)23(28)25(18,12-14(13)2)24(29)17-10-20(30-3)21(31-4)11-19(17)26/h5-8,10-11,18H,9,12H2,1-4H3

description: This dataset contains experimental data from a sample (InChI=1S/C25H23BrO5/c1-13-9-18-22(27)15-7-5-6-8-16(15)23(28)25(18,12-14(13)2)24(29)17-10-20(30-3)21(31-4)11-19(17)26/h5-8,10-11,18H,9,12H2,1-4H3). 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) fast-atom bombardment mass spectrometry (FABMS)
DOI: 10.14272/fdosukyerhqqqo-uhfffaoysa-n/chmo0000563
title: fast-atom bombardment mass spectrometry (FABMS) ()
title: InChI=1S/C25H23BrO5/c1-13-9-18-22(27)15-7-5-6-8-16(15)23(28)25(18,12-14(13)2)24(29)17-10-20(30-3)21(31-4)11-19(17)26/h5-8,10-11,18H,9,12H2,1-4H3

description: dataset for fast-atom bombardment mass spectrometry (FABMS) MS (FAB, 3‑NBA), m/z (%): 483/485 (9/7) [M+H]+, 243/245 (80/80) [C9H9BrO3].HRMS (FAB, C25H24O579Br): calc. 483.0807; found 483.0808.
DOI: 10.14272/fdosukyerhqqqo-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C25H23BrO5/c1-13-9-18-22(27)15-7-5-6-8-16(15)23(28)25(18,12-14(13)2)24(29)17-10-20(30-3)21(31-4)11-19(17)26/h5-8,10-11,18H,9,12H2,1-4H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.13 (dd, 3J = 7.6 Hz, 4J = 1.4 Hz, 1H, CHAr), 8.00 (dd, 3J = 7.7 Hz, 4J = 1.3 Hz, 1H, CHAr), 7.77 (td, 3J = 7.5 Hz, 4J = 1.4 Hz, 1H, CHAr), 7.72 (td, 3J = 7.5 Hz, 4J = 1.4 Hz, 1H, CHAr), 7.00 (s, 1H, CHAr), 6.91 (s, 1H, CHAr), 3.87 (s, 3H, OCH3), 3.83 (s, 3H, OCH3), 3.74–3.69 (m, 1H, CH), 2.94–2.77 (m, 1H, CHH), 2.43–2.23 (m, 3H, CHH + CH2), 1.59 (s, 3H, CH3), 1.55 (s, 3H, CH3).Impurities: spectrum contains grease signal at 0.07 ppm.
DOI: 10.14272/fdosukyerhqqqo-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C25H23BrO5/c1-13-9-18-22(27)15-7-5-6-8-16(15)23(28)25(18,12-14(13)2)24(29)17-10-20(30-3)21(31-4)11-19(17)26/h5-8,10-11,18H,9,12H2,1-4H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (126 MHz, CDCl3, ppm) δ = 198.9 (Cq, 1 × C=O), 196.5 (Cq, 1 × C=O), 195.6 (Cq, 1 × C=O), 150.8 (Cq, 1 × CqAr), 147.4 (Cq, 1 × CqAr), 135.2 (Cq, 1 × CqAr), 134.3 (+, 2 × CHAr), 133.3 (Cq, 1 × CqAr), 130.9 (Cq, 1 × CqAr), 127.2 (+, 1 × CHAr), 127.1 (+, 1 × CHAr), 124.1 (Cq, 1 × CqAr), 122.9 (Cq, 1 × Cq), 116.7 (+, 1 × CHAr), 111.8 (Cq, 1 × Cq), 110.9 (+, 1 × CHAr), 68.7 (Cq, 1 × Cq), 56.4 (+, 1 × OCH3), 56.3 (+, 1 × OCH3), 50.4 (+, 1 × CH), 34.9 (–, 1 × CH2), 31.6 (–, 1 × CH2), 19.1 (+, 1 × CH3), 18.8 (+, 1 × CH3).
DOI: 10.14272/fdosukyerhqqqo-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C25H23BrO5/c1-13-9-18-22(27)15-7-5-6-8-16(15)23(28)25(18,12-14(13)2)24(29)17-10-20(30-3)21(31-4)11-19(17)26/h5-8,10-11,18H,9,12H2,1-4H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR): ṽ = 2911 (w), 1676 (vs), 1592 (s), 1504 (vs), 1439 (m), 1370 (m), 1329 (m), 1256 (vs), 1200 (vs), 1169 (vs), 1057 (s), 1024 (s), 858 (w), 788 (m), 749 (vs) cm–1.
DOI: 10.14272/wmzngtslfsjhmz-uhfffaoysa-n.1
title: 3-methoxycarbonylbenzoic acid
title: InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)

description: This dataset contains experimental data from a sample (3-methoxycarbonylbenzoic acid, InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)). The datasets from the following experiments are available: 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) mass spectrometry (MS) infrared absorption spectroscopy (IR)
DOI: 10.14272/wmzngtslfsjhmz-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (3-methoxycarbonylbenzoic acid)
title: InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 90 °C): 180 (45) [M]+, 163 (2) [M–OH]+, 149 (100) [M–OCH3]+, 135 (4) [M–CO2H]+, 121 (18) [M–CO2CH3]+. HRMS–EI (m/z): [M]+ calcd for C9H8O4, 180.0423; found, 180.0423.
DOI: 10.14272/wmzngtslfsjhmz-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (3-methoxycarbonylbenzoic acid)
title: InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.79 (s, 1H, CH), 8.30 (s, 2H, CH), 7.60 (t, 1H, J = 7.0 Hz, CH), 3.98 (s, 3H, CO2CH3). Missing signal (1H, CO2H).
DOI: 10.14272/wmzngtslfsjhmz-uhfffaoysa-n/chmo0000593.1
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (3-methoxycarbonylbenzoic acid)
title: InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, DMSO-d6, ppm) δ = 13.32 (bs, 1H, CO2H), 8.48 (t, 1H, J = 1.5 Hz, CH), 8.20–8.17 (m, 2H, CH), 7.67 (t, 1H, J = 8.0 Hz, CH), 3.89 (s, 3H, CO2CH3).
DOI: 10.14272/wmzngtslfsjhmz-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (3-methoxycarbonylbenzoic acid)
title: InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 170.5 (CO2H), 166.1 (CO2CH3), 134.7 (CH), 134.3 (CH), 131.4 (CH), 130.8 (Cq), 129.6 (Cq), 128.8 (CH), 52.4 (CO2CH3).
DOI: 10.14272/wmzngtslfsjhmz-uhfffaoysa-n/chmo0000595.1
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (3-methoxycarbonylbenzoic acid)
title: InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, DMSO-d6, ppm) δ = 166.4 (CO2H), 165.5 (CO2CH3), 133.8 (CH), 133.2 (CH), 131.4 (Cq), 130.0 (Cq), 129.7 (CH), 129.4 (CH), 52.4 (CO2CH3).
DOI: 10.14272/wmzngtslfsjhmz-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (3-methoxycarbonylbenzoic acid)
title: InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3088, 2966, 2825, 1728, 1677, 1609, 1456, 1434, 1329, 1316, 1295, 1265, 1190, 1162, 1142, 1094, 1075, 962, 928, 881, 724, 704, 671, 657, 565, 484 cm–1.
DOI: 10.14457/kku.the.1996.106
title: การเปรียบเทียบผลสัมฤทธิ์ทางการเรียนวิชาฟิสิกส์ชั้นมัธยมศึกษาปีที่ 6 เรื่องโครงสร้างอะตอมโดยใช้รูปแบบการสอน กลุ่มเพื่อนช่วยเพื่อนกับวิธีสอนปกติ
DOI: 10.14457/kku.the.1996.107
title: การศึกษาพฤติกรรมการตัดสินใจของผู้บริหารโรงเรียนประถมศึกษา สังกัดสำนักงานการประถมศึกษาจังหวัดหนองคาย
DOI: 10.14457/kku.the.1996.108
title: ผลของสารควบคุมการเจริญเติบโตของพืชต่อการติดผล การพัฒนาการและคุณภาพของน้อยหน่า (Annona squamosa Linn.)
DOI: 10.14457/kku.the.1996.109
title: จิตลักษณะกับพฤติกรรมการทำงานของพนักงานสอบสวนในสังกัดตำรวจภูธรจังหวัดขอนแก่นและจังหวัดมุกดาหาร กับความพึงพอใจของประชาชนต่อการปฏิบัติงานของตำรวจ
DOI: 10.14457/kku.the.1996.110
title: ความคิดเห็นของเกษตรกรต่อโครงการปรับปรุงที่ดินเพื่อเพิ่มผลผลิตในนาข้าว ของธนาคารเพื่อการเกษตรและสหกรณ์การเกษตร ในจังหวัดขอนแก่น
DOI: 10.5281/zenodo.3813633
title: Replication Package of Augmenting Commit Classification using Fine-Grained Source Code Changes and Deep Neural Networks

description: Replication Package of Augmenting Commit Classification using Fine-Grained Source Code Changes and Deep Neural Networks
DOI: 10.14272/vqhshkajcslgop-uhfffaoysa-n.1
title: C23H19BrO3
title: InChI=1S/C23H19BrO3/c1-13-11-18-20(25)15-7-3-4-8-16(15)21(26)23(18,12-14(13)2)22(27)17-9-5-6-10-19(17)24/h3-10,18H,11-12H2,1-2H3

description: This dataset contains experimental data from a sample (InChI=1S/C23H19BrO3/c1-13-11-18-20(25)15-7-3-4-8-16(15)21(26)23(18,12-14(13)2)22(27)17-9-5-6-10-19(17)24/h3-10,18H,11-12H2,1-2H3). 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) fast-atom bombardment mass spectrometry (FABMS)
DOI: 10.14272/vqhshkajcslgop-uhfffaoysa-n/chmo0000563
title: fast-atom bombardment mass spectrometry (FABMS) ()
title: InChI=1S/C23H19BrO3/c1-13-11-18-20(25)15-7-3-4-8-16(15)21(26)23(18,12-14(13)2)22(27)17-9-5-6-10-19(17)24/h3-10,18H,11-12H2,1-2H3

description: dataset for fast-atom bombardment mass spectrometry (FABMS) MS (FAB, 3‑NBA), m/z (%): 423/425 (24/21) [M+H]+, 239 (100), 183/185 (92/89).HRMS (FAB, C23H20O379Br): calc. 423.0596; found 423.0597.
DOI: 10.14272/vqhshkajcslgop-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C23H19BrO3/c1-13-11-18-20(25)15-7-3-4-8-16(15)21(26)23(18,12-14(13)2)22(27)17-9-5-6-10-19(17)24/h3-10,18H,11-12H2,1-2H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.14 (dd, 3J = 7.6 Hz, 4J = 1.4 Hz, 1H, CHAr), 8.03 (dd, 3J = 7.7 Hz, 4J = 1.4 Hz, 1H, CHAr), 7.78 (td, 3J = 7.5 Hz, 4J = 1.5 Hz, 1H, CHAr), 7.74 (td, 3J = 7.5 Hz, 4J = 1.5 Hz, 1H, CHAr), 7.59–7.56 (m, 1H, CHAr), 7.31–7.23 (m, 3H, CHAr), 3.73 (dd, 3J = 8.5, 6.7 Hz, 1H, CH), 2.79 (dt, 2J = 16.8 Hz, 3J = 2.2 Hz, 1H, CHH), 2.45–2.22 (m, 3H, CHH, CH2), 1.60 (s, 3H, CH3), 1.51 (s, 3H, CH3). Impurities: spectrum contains ethyl acetate signals at 2.05 and 1.26 ppm and grease signal at 0.07 ppm.
DOI: 10.14272/vqhshkajcslgop-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C23H19BrO3/c1-13-11-18-20(25)15-7-3-4-8-16(15)21(26)23(18,12-14(13)2)22(27)17-9-5-6-10-19(17)24/h3-10,18H,11-12H2,1-2H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 200.2 (Cq, 1 × C=O), 196.5 (Cq, 1 × C=O), 194.9 (Cq, 1 × C=O), 139.2 (Cq, 1 × CqAr), 135.2 (+, 1 × CHAr), 134.4 (Cq, 1 × CqAr), 134.3 (+, 1 × CHAr), 134.1 (+, 1 × CHAr), 133.2 (Cq, 1 × CqAr), 131.4 (+, 1 × CHAr), 127.5 (+, 1 × CHAr), 127.4 (+, 1 × CHAr), 127.2 (+, 1 × CHAr), 126.7 (+, 1 × CHAr), 124.2 (Cq, 1 × CqAr), 122.9 (Cq, 1 × Cq), 120.0 (Cq, 1 × Cq), 68.6 (Cq, 1 × Cq), 50.2 (+, 1 × CH), 34.4 (–, 1 × CH2), 31.6 (–, 1 × CH2), 19.1 (+, 1 × CH3), 18.8 (+, 1 × CH3).
DOI: 10.14272/vqhshkajcslgop-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C23H19BrO3/c1-13-11-18-20(25)15-7-3-4-8-16(15)21(26)23(18,12-14(13)2)22(27)17-9-5-6-10-19(17)24/h3-10,18H,11-12H2,1-2H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR): ṽ = 1694 (vs), 1679 (vs), 1589 (m), 1273 (m), 1256 (vs), 1247 (vs), 1214 (m), 1201 (s), 1057 (m), 1027 (m), 972 (m), 887 (m), 790 (m), 765 (s), 738 (vs), 711 (s), 688 (m), 674 (m), 635 (m), 586 (s), 551 (m), 439 (m), 422 (m), 408 (w), 394 (w) cm–1.
DOI: 10.14457/kku.the.1996.111
title: ความสัมพันธ์ระหว่างการสนับสนุนทางสังคม แหล่งสนับสนุนกับพฤติกรรมแสวงหาการดูแลสุขภาพของบิดามารดา ที่มีบุตรป่วยเป็นโรคติดเชื้อเฉียบพลันทางเดินหายใจ ในเด็กอายุต่ำกว่า 5 ปี
DOI: 10.14457/kku.the.1996.112
title: การเปรียบเทียบผลสัมฤทธิ์ทางการเรียนวิชาคณิตศาสตร์ของนักเรียนชั้นประถมศึกษาปีที่ 2 ระหว่างวิธีสอนโดยใช้สิ่งช่วยจัดมโนมติล่วงหน้ากับการสอนตามปกติ
DOI: 10.14457/kku.the.1996.113
title: ความสัมพันธ์ระหว่างการรับรู้ เจตคติกับการปฏิบัติงานเกี่ยวกับโรคเอดส์ของเจ้าหน้าที่สถานีอนามัย สังกัดสำนักงานสาธารณสุขจังหวัดขอนแก่น
DOI: 10.14457/kku.the.1996.114
title: ผลของโปรแกรมการใช้ข้อมูลเกี่ยวกับสิ่งเร้าต่อการปรับตัวในผู้ป่วยเบาหวาน ที่ได้รับการวินิจฉัยในครั้งแรก
DOI: 10.14457/kku.the.1996.115
title: รูปแบบการผุของฟันน้ำนมในเด็ก 3 และ 6 ปี : จังหวัดมหาสารคาม
DOI: 10.14457/kku.the.1996.116
title: การสร้างแบบทดสอบวัดความถนัดทางทันตาภิบาล
DOI: 10.14457/kku.the.1996.117
title: ปัจจัยที่มีผลต่อพฤติกรรมกล้าแสดงออกของนักศึกษามหาวิทยาลัยขอนแก่น
DOI: 10.7910/dvn/28075/zhriy8
title: events.2020.20200506093336.tab.zip

description: Event data for 2020 through end of April. Purely US domestic events are omitted.
DOI: 10.14272/bgjibrafuhboih-hraatjiysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C21H15BrO3/c22-17-11-4-3-9-15(17)20(25)21-12-6-5-10-16(21)18(23)13-7-1-2-8-14(13)19(21)24/h1-9,11,16H,10,12H2/t16-,21+/m0/s1

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (101 MHz, CDCl3, ppm) δ = 199.9 (Cq, 1 × C=O), 196.2 (Cq, 1 × C=O), 193.9 (Cq, 1 × C=O), 139.2 (Cq, 1 × CqAr), 135.3 (+, 1 × CHAr), 134.3 (+, 1 × CHAr), 134.2 (Cq, 1 × CqAr), 134.1 (+, 1 × CHAr), 133.1 (Cq, 1 × CqAr), 131.6 (+, 1 × CHAr), 127.4 (+, 1 × CHAr), 127.2 (+, 2 × CHAr), 126.8 (+, 1 × CHAr), 124.5 (+, 1 × C=CH), 123.8 (+, 1 × C=CH), 119.8 (Cq, 1 × CqAr), 68.3 (Cq, 1 × Cq), 49.7 (+, 1 × CH), 28.2 (–, 1 × CH2), 26.2 (–, 1 × CH2).