cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.14272/svtdxkpybjxbjr-uhfffaoysa-n.1
title: 5-chloro-2-phenyl-1,3-benzothiazole
title: InChI=1S/C13H8ClNS/c14-10-6-7-12-11(8-10)15-13(16-12)9-4-2-1-3-5-9/h1-8H

description: This dataset contains experimental data from a sample (5-chloro-2-phenyl-1,3-benzothiazole, InChI=1S/C13H8ClNS/c14-10-6-7-12-11(8-10)15-13(16-12)9-4-2-1-3-5-9/h1-8H). 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)
DOI: 10.14272/qnpxqkvfkdiped-uhfffaoysa-n/chmo0000470.1
title: mass spectrometry (MS) ()
title: InChI=1S/C17H17ClN2S/c1-3-20(4-2)14-8-5-12(6-9-14)17-19-15-11-13(18)7-10-16(15)21-17/h5-11H,3-4H2,1-2H3

description: dataset for mass spectrometry (MS) HRMS (C17H17N2ClS): Calcd 316.0795, Found 316.0794.
DOI: 10.14272/qnpxqkvfkdiped-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C17H17ClN2S/c1-3-20(4-2)14-8-5-12(6-9-14)17-19-15-11-13(18)7-10-16(15)21-17/h5-11H,3-4H2,1-2H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, ppm) δ = 170.6, 155.3, 149.9, 132.7, 131.7, 129.2 (2C), 124.2, 121.9, 121.8, 119.9, 111.0 (2C), 44.4 (2C), 12.5 (2C).
DOI: 10.14272/qnpxqkvfkdiped-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C17H17ClN2S/c1-3-20(4-2)14-8-5-12(6-9-14)17-19-15-11-13(18)7-10-16(15)21-17/h5-11H,3-4H2,1-2H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 2964, 2923, 2894, 2870, 1600, 1582, 1546, 1529, 1480, 1470, 1429, 1408, 1375, 1352, 1315, 1267, 1246, 1228, 1188, 1154, 1143, 1095, 1071, 1014, 1003, 963, 935, 901, 867, 821, 792, 736, 728, 695, 627, 581, 537, 513, 433, 408 cm–1.
DOI: 10.14272/svtdxkpybjxbjr-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (5-chloro-2-phenyl-1,3-benzothiazole)
title: InChI=1S/C13H8ClNS/c14-10-6-7-12-11(8-10)15-13(16-12)9-4-2-1-3-5-9/h1-8H

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.04–8.09 (m, 3H), 7.78 (d, J = 8.5 Hz, 1H), 7.47–7.52 (m, 3H), 7.37 (dd, J = 8.5 Hz, J = 2.0 Hz, 1H).
DOI: 10.14272/svtdxkpybjxbjr-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (5-chloro-2-phenyl-1,3-benzothiazole)
title: InChI=1S/C13H8ClNS/c14-10-6-7-12-11(8-10)15-13(16-12)9-4-2-1-3-5-9/h1-8H

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 169.8, 154.9, 133.2, 133.2, 132.2, 131.3, 129.0, 127.5 (2C), 125.6, 122.9, 122.2, 26.9.
DOI: 10.14272/qnpxqkvfkdiped-uhfffaoysa-n.1
title: C17H17ClN2S
title: InChI=1S/C17H17ClN2S/c1-3-20(4-2)14-8-5-12(6-9-14)17-19-15-11-13(18)7-10-16(15)21-17/h5-11H,3-4H2,1-2H3

description: This dataset contains experimental data from a sample (InChI=1S/C17H17ClN2S/c1-3-20(4-2)14-8-5-12(6-9-14)17-19-15-11-13(18)7-10-16(15)21-17/h5-11H,3-4H2,1-2H3). The datasets from the following experiments are available: infrared absorption spectroscopy (IR) mass spectrometry (MS) mass spectrometry (MS) 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/qnpxqkvfkdiped-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C17H17ClN2S/c1-3-20(4-2)14-8-5-12(6-9-14)17-19-15-11-13(18)7-10-16(15)21-17/h5-11H,3-4H2,1-2H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, ppm) δ = 7.95 (d, J = 2.0 Hz, 1H), 7.88–7.92 (m, 2H), 7.70 (d, J = 8.4 Hz, 1H), 7.25 (dd, J = 8.4 Hz, J = 2.0 Hz, 1H), 6.66–6.71 (m, 2H), 3.42 (q, J = 7.2 Hz, 4H), 1.21 (t, J = 7.1 Hz, 6 H).
DOI: 10.14272/xbhouxsghyzcnh-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (2-phenyl-1,3-benzothiazole)
title: InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 40 °C): 331 (12), 262 (11), 243 (14), 231 (18), 211 (100), 181 (88), 162 (13), 131 (71), 119 (11), 108 (19), 100 (12), 69 (57).
DOI: 10.14272/jiwvtdbbmgstfi-uhfffaoysa-n
title: 3-(1,3-benzothiazol-2-yl)phenol
title: InChI=1S/C13H9NOS/c15-10-5-3-4-9(8-10)13-14-11-6-1-2-7-12(11)16-13/h1-8,15H

description: This dataset contains experimental data from a sample (3-(1,3-benzothiazol-2-yl)phenol, InChI=1S/C13H9NOS/c15-10-5-3-4-9(8-10)13-14-11-6-1-2-7-12(11)16-13/h1-8,15H). The datasets from the following experiments are available: 13C nuclear magnetic resonance spectroscopy (13C NMR) 1H nuclear magnetic resonance spectroscopy (1H NMR) infrared absorption spectroscopy (IR) mass spectrometry (MS)
DOI: 10.14272/jiwvtdbbmgstfi-uhfffaoysa-n/chmo0000470.1
title: mass spectrometry (MS) (3-(1,3-benzothiazol-2-yl)phenol)
title: InChI=1S/C13H9NOS/c15-10-5-3-4-9(8-10)13-14-11-6-1-2-7-12(11)16-13/h1-8,15H

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 80 °C): 227 (100) [M+], 199 (11), 121 (17), 108 (13), 69 (11), 58 (22). HRMS (C13H9NOS): calcd 227.0405, found 227.0404.
DOI: 10.14272/jiwvtdbbmgstfi-uhfffaoysa-n/chmo0000593.1
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (3-(1,3-benzothiazol-2-yl)phenol)
title: InChI=1S/C13H9NOS/c15-10-5-3-4-9(8-10)13-14-11-6-1-2-7-12(11)16-13/h1-8,15H

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (400 MHz, methanol-d4, ppm) δ = 7.95–8.03 (m, 2H), 7.49–7.55 (m, 3H), 7.39–7.45 (m, 1H), 7.31–7.37 (m, 1H), 6.94–6.99 (m, 1H). Missing Signal (1H, OH) due to H/D exchange in MeOD-d4.
DOI: 10.14272/jiwvtdbbmgstfi-uhfffaoysa-n/chmo0000595.1
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (3-(1,3-benzothiazol-2-yl)phenol)
title: InChI=1S/C13H9NOS/c15-10-5-3-4-9(8-10)13-14-11-6-1-2-7-12(11)16-13/h1-8,15H

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (100 MHz, Methanol-d4, ppm) δ = 115.0, 119.6, 119.9, 123.1, 123.8, 126.8, 127.8, 131.5, 135.9, 136.2, 155.1, 159.5, 170.3.
DOI: 10.14272/jiwvtdbbmgstfi-uhfffaoysa-n/chmo0000630.1
title: infrared absorption spectroscopy (IR) (3-(1,3-benzothiazol-2-yl)phenol)
title: InChI=1S/C13H9NOS/c15-10-5-3-4-9(8-10)13-14-11-6-1-2-7-12(11)16-13/h1-8,15H

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 425, 442, 521, 571, 653, 667, 679, 703, 724, 752, 772, 819, 849, 864, 884, 966, 996, 1013, 1024, 1075, 1082, 1103, 1129, 1157, 1200, 1218, 1230, 1241, 1266, 1293, 1313, 1333, 1357, 1436, 1479, 1514, 1558, 1598, 2438, 2560, 2693, 2796, 3014, 3057 cm–1.
DOI: 10.14272/xbhouxsghyzcnh-uhfffaoysa-n.1
title: 2-phenyl-1,3-benzothiazole
title: InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H

description: This dataset contains experimental data from a sample (2-phenyl-1,3-benzothiazole, InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H). 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)
DOI: 10.14272/xbhouxsghyzcnh-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (2-phenyl-1,3-benzothiazole)
title: InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.09–8.15 (m, 3H), 7.90 (dd, J = 7.9 Hz, J = 0.5 Hz, 1H), 7.47–7.53 (m, 4H), 7.37–7.42 (m, 1 H).
DOI: 10.14272/xbhouxsghyzcnh-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (2-phenyl-1,3-benzothiazole)
title: InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 168.0, 154.0, 135.0, 133.5, 130.9, 128.9 (2C), 127.5 (2C), 126.2, 125.1, 123.1, 121.5.
DOI: 10.14272/xbhouxsghyzcnh-uhfffaoysa-n/chmo0000470.1
title: mass spectrometry (MS) (2-phenyl-1,3-benzothiazole)
title: InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H

description: dataset for mass spectrometry (MS) HRMS (C13H9NS): Calcd 211.0450, Found 211.0451.
DOI: 10.14272/xbhouxsghyzcnh-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (2-phenyl-1,3-benzothiazole)
title: InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3060, 1587, 1553, 1509, 1500, 1477, 1453, 1444, 1432, 1412, 1389, 1334, 1311, 1283, 1252, 1223, 1180, 1158, 1121, 1099, 1069, 1028, 1010, 1000, 987, 961, 943, 939, 916, 862, 854, 758, 729, 697, 685, 666, 622, 564, 549, 466, 430 cm–1.
DOI: 10.14272/kgppssiwsdmfrl-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (6-methyl-2-(3,4,5-trifluorophenyl)-1,3-benzothiazole)
title: InChI=1S/C14H8F3NS/c1-7-2-3-11-12(4-7)19-14(18-11)8-5-9(15)13(17)10(16)6-8/h2-6H,1H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 1625, 1598, 1557, 1534, 1496, 1435, 1402, 1383, 1347, 1306, 1276, 1247, 1238, 1208, 1163, 1129, 1062, 1045, 1028, 909, 867, 849, 813, 802, 742, 701, 688, 656, 608, 585, 535, 526, 514, 432, 384 cm–1.
DOI: 10.14272/qbuuskfcozcdnq-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (4-(6-methyl-1,3-benzothiazol-2-yl)-N-propan-2-ylaniline)
title: InChI=1S/C17H18N2S/c1-11(2)18-14-7-5-13(6-8-14)17-19-15-9-4-12(3)10-16(15)20-17/h4-11,18H,1-3H3

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 110 °C): 282 (72), 267 (100), 239 (11), 231 (10), 219 (10), 181 (26), 169 (15), 131 (29), 119 (16), 69 (66).
DOI: 10.14272/kgppssiwsdmfrl-uhfffaoysa-n.2
title: C14H8F3NS
title: InChI=1S/C14H8F3NS/c1-7-2-3-11-12(4-7)19-14(18-11)8-5-9(15)13(17)10(16)6-8/h2-6H,1H3

description: This dataset contains experimental data from a sample (6-methyl-2-(3,4,5-trifluorophenyl)-1,3-benzothiazole, InChI=1S/C14H8F3NS/c1-7-2-3-11-12(4-7)19-14(18-11)8-5-9(15)13(17)10(16)6-8/h2-6H,1H3). The datasets from the following experiments are available: infrared absorption spectroscopy (IR) mass spectrometry (MS) 1H nuclear magnetic resonance spectroscopy (1H NMR) 13C nuclear magnetic resonance spectroscopy (13C NMR) 19F nuclear magnetic resonance spectroscopy (19F NMR)
DOI: 10.14272/kgppssiwsdmfrl-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (6-methyl-2-(3,4,5-trifluorophenyl)-1,3-benzothiazole)
title: InChI=1S/C14H8F3NS/c1-7-2-3-11-12(4-7)19-14(18-11)8-5-9(15)13(17)10(16)6-8/h2-6H,1H3

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 30 °C): 279 (100), 121 (22), 69 (17), 58 (10). HRMS (C14H8NF3S): Calcd 279.0330, Found 279.0331.
DOI: 10.14272/qbuuskfcozcdnq-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (4-(6-methyl-1,3-benzothiazol-2-yl)-N-propan-2-ylaniline)
title: InChI=1S/C17H18N2S/c1-11(2)18-14-7-5-13(6-8-14)17-19-15-9-4-12(3)10-16(15)20-17/h4-11,18H,1-3H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 167.7, 152.3, 149.6, 134.6, 134.1, 128.9 (2C), 127.4, 122.2, 121.7, 121.1, 112.5 (2C), 43.9, 22.7 (2C), 21.4.
DOI: 10.14272/qbuuskfcozcdnq-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (4-(6-methyl-1,3-benzothiazol-2-yl)-N-propan-2-ylaniline)
title: InChI=1S/C17H18N2S/c1-11(2)18-14-7-5-13(6-8-14)17-19-15-9-4-12(3)10-16(15)20-17/h4-11,18H,1-3H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3373, 2974, 2962, 2911, 2903, 2863, 1606, 1572, 1556, 1524, 1478, 1449, 1416, 1381, 1362, 1327, 1310, 1283, 1257, 1229, 1184, 1140, 1117, 1063, 1005, 977, 961, 946, 881, 828, 811, 725, 707, 690, 623, 568, 520, 473, 436, 389 cm–1.
DOI: 10.14272/qbuuskfcozcdnq-uhfffaoysa-n.1
title: 4-(6-methyl-1,3-benzothiazol-2-yl)-N-propan-2-ylaniline
title: InChI=1S/C17H18N2S/c1-11(2)18-14-7-5-13(6-8-14)17-19-15-9-4-12(3)10-16(15)20-17/h4-11,18H,1-3H3

description: This dataset contains experimental data from a sample (4-(6-methyl-1,3-benzothiazol-2-yl)-N-propan-2-ylaniline, InChI=1S/C17H18N2S/c1-11(2)18-14-7-5-13(6-8-14)17-19-15-9-4-12(3)10-16(15)20-17/h4-11,18H,1-3H3). 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)
DOI: 10.14272/qbuuskfcozcdnq-uhfffaoysa-n/chmo0000470.1
title: mass spectrometry (MS) (4-(6-methyl-1,3-benzothiazol-2-yl)-N-propan-2-ylaniline)
title: InChI=1S/C17H18N2S/c1-11(2)18-14-7-5-13(6-8-14)17-19-15-9-4-12(3)10-16(15)20-17/h4-11,18H,1-3H3

description: dataset for mass spectrometry (MS) HRMS (C17H18N2S): Calcd 282.1185, Found 282.1185.
DOI: 10.14272/qbuuskfcozcdnq-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (4-(6-methyl-1,3-benzothiazol-2-yl)-N-propan-2-ylaniline)
title: InChI=1S/C17H18N2S/c1-11(2)18-14-7-5-13(6-8-14)17-19-15-9-4-12(3)10-16(15)20-17/h4-11,18H,1-3H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 7.88–7.95 (m, 3H), 7.64 (s, 1H), 7.25–7.30 (dd, J = 8.3 Hz, J = 1.1 Hz, 1H), 6.61–6.65 (m, 2H), 3.97 (br. s., 1H), 3.72 (spt, J = 6.3 Hz, 1H), 2.50 (s, 3H), 1.26 (d, J = 6.3 Hz, 6H).
DOI: 10.14272/xnpqnknzbzipfj-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C14H7ClN2S/c15-11-5-6-13-12(7-11)17-14(18-13)10-3-1-9(8-16)2-4-10/h1-7H

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 167.1, 154.7, 137.0, 133.5, 132.9, 132.8 (2C), 127.9 (2C), 126.6, 123.5, 122.5, 118.1, 114.5.
DOI: 10.14272/xnpqnknzbzipfj-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C14H7ClN2S/c15-11-5-6-13-12(7-11)17-14(18-13)10-3-1-9(8-16)2-4-10/h1-7H

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 2229, 1606, 1589, 1545, 1478, 1433, 1405, 1313, 1262, 1222, 1182, 1146, 1110, 1062, 1015, 969, 903, 862, 851, 844, 834, 823, 800, 773, 736, 702, 640, 623, 581, 538, 503, 447, 423 cm–1.
DOI: 10.14272/xnpqnknzbzipfj-uhfffaoysa-n.1
title: C14H7ClN2S
title: InChI=1S/C14H7ClN2S/c15-11-5-6-13-12(7-11)17-14(18-13)10-3-1-9(8-16)2-4-10/h1-7H

description: This dataset contains experimental data from a sample (InChI=1S/C14H7ClN2S/c15-11-5-6-13-12(7-11)17-14(18-13)10-3-1-9(8-16)2-4-10/h1-7H). 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)
DOI: 10.14272/xnpqnknzbzipfj-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) ()
title: InChI=1S/C14H7ClN2S/c15-11-5-6-13-12(7-11)17-14(18-13)10-3-1-9(8-16)2-4-10/h1-7H

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 90 °C): 381 (10), 331 (13), 270 (32), 262 (10), 243 (12), 231 (15), 181 (67), 162 (10), 131 (65), 119 (15), 100 (15), 69 (100). HRMS (C14H7N2ClS): Calcd 270.0013, Found 270.0012.
DOI: 10.14272/xnpqnknzbzipfj-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C14H7ClN2S/c15-11-5-6-13-12(7-11)17-14(18-13)10-3-1-9(8-16)2-4-10/h1-7H

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.20–8.18 (m, 2H), 8.10 (d, J = 2.0 Hz, 1H), 7.86 (d, J = 8.5 Hz, 1H), 7.82–7.76 (m, 2H), 7.42 (dd, J = 8.5 Hz, J = 2.0 Hz, 1H).
DOI: 10.14272/dfnvjqoytshvcu-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (N-benzyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline)
title: InChI=1S/C21H18N2S/c1-15-7-12-19-20(13-15)24-21(23-19)17-8-10-18(11-9-17)22-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 167.6, 152.3, 150.2, 138.5, 134.6, 134.3, 128.9 (2C), 128.7 (2C), 127.5, 127.4, 127.4 (2C), 123.0, 121.8, 121.2, 112.5 (2C), 47.8, 21.4.
DOI: 10.14272/dfnvjqoytshvcu-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (N-benzyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline)
title: InChI=1S/C21H18N2S/c1-15-7-12-19-20(13-15)24-21(23-19)17-8-10-18(11-9-17)22-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 150 °C): 330 (100), 239 (40), 231 (11), 181 (48), 131 (55), 119 (10), 100 (15), 91 (40), 69 (85). HRMS (C21H18N2S): Calcd 330.1185, Found 330.1184.
DOI: 10.14272/dfnvjqoytshvcu-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (N-benzyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline)
title: InChI=1S/C21H18N2S/c1-15-7-12-19-20(13-15)24-21(23-19)17-8-10-18(11-9-17)22-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 7.91–7.89 (m, 2H), 7.88 (d, J = 8.4 Hz, 1H), 7.64 (s, 1H), 7.38–7.25 (m, 6H), 6.69–6.68 (m, 2H), 4.46 (br. s., 1H), 4.41 (s, 2H), 2.49 (s, 3H).
DOI: 10.14272/dfnvjqoytshvcu-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (N-benzyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline)
title: InChI=1S/C21H18N2S/c1-15-7-12-19-20(13-15)24-21(23-19)17-8-10-18(11-9-17)22-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3401, 3026, 3018, 2911, 2870, 2856, 2842, 1606, 1570, 1556, 1525, 1490, 1474, 1450, 1442, 1412, 1351, 1331, 1308, 1281, 1263, 1255, 1240, 1225, 1178, 1154, 1136, 1126, 1110, 1071, 1027, 1008, 994, 964, 953, 889, 875, 816, 724, 704, 688, 646, 623, 566, 514, 503, 460, 438, 412, 389 cm–1.
DOI: 10.14272/dfnvjqoytshvcu-uhfffaoysa-n.1
title: N-benzyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline
title: InChI=1S/C21H18N2S/c1-15-7-12-19-20(13-15)24-21(23-19)17-8-10-18(11-9-17)22-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3

description: This dataset contains experimental data from a sample (N-benzyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline, InChI=1S/C21H18N2S/c1-15-7-12-19-20(13-15)24-21(23-19)17-8-10-18(11-9-17)22-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3). 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)
DOI: 10.14272/yyvnjmdzxbheaa-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (6-methyl-2-(4-nitrophenyl)-1,3-benzothiazole)
title: InChI=1S/C14H10N2O2S/c1-9-2-7-12-13(8-9)19-14(15-12)10-3-5-11(6-4-10)16(17)18/h2-8H,1H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 1603, 1593, 1552, 1514, 1504, 1474, 1443, 1406, 1378, 1337, 1320, 1308, 1253, 1235, 1221, 1205, 1172, 1133, 1106, 1059, 1037, 1012, 971, 889, 848, 814, 750, 721, 685, 613, 561, 532, 517, 477, 432, 416 cm–1.
DOI: 10.14272/yyvnjmdzxbheaa-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (6-methyl-2-(4-nitrophenyl)-1,3-benzothiazole)
title: InChI=1S/C14H10N2O2S/c1-9-2-7-12-13(8-9)19-14(15-12)10-3-5-11(6-4-10)16(17)18/h2-8H,1H3

description: dataset for mass spectrometry (MS) EI (m/z, 70 eV, 110 °C): 270 (100), 231 (16), 224 (34), 209 (19), 181 (50), 169 (11), 131 (53), 119 (18), 100 (13), 69 (99). HRMS (C14H10O2N2S): Calcd 270.0458, Found 270.0456.
DOI: 10.14272/yyvnjmdzxbheaa-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (6-methyl-2-(4-nitrophenyl)-1,3-benzothiazole)
title: InChI=1S/C14H10N2O2S/c1-9-2-7-12-13(8-9)19-14(15-12)10-3-5-11(6-4-10)16(17)18/h2-8H,1H3

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR) 1H NMR (500 MHz, CDCl3, ppm) δ = 8.15–8.46 (m, 4H), 8.01 (d, J = 8.2 Hz, 1H), 7.74 (s., 1H), 7.37 (d, J = 7.9 Hz, 1H), 2.53 (s., 3H).
DOI: 10.14272/yyvnjmdzxbheaa-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (6-methyl-2-(4-nitrophenyl)-1,3-benzothiazole)
title: InChI=1S/C14H10N2O2S/c1-9-2-7-12-13(8-9)19-14(15-12)10-3-5-11(6-4-10)16(17)18/h2-8H,1H3

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR) 13C NMR (125 MHz, CDCl3, ppm) δ = 163.7, 152.1, 148.8, 139.2, 136.7, 135.6, 128.6, 128.0 (2C), 124.3 (2C), 123.3, 121.5, 21.6.
DOI: 10.14272/yyvnjmdzxbheaa-uhfffaoysa-n.1
title: 6-methyl-2-(4-nitrophenyl)-1,3-benzothiazole
title: InChI=1S/C14H10N2O2S/c1-9-2-7-12-13(8-9)19-14(15-12)10-3-5-11(6-4-10)16(17)18/h2-8H,1H3

description: This dataset contains experimental data from a sample (6-methyl-2-(4-nitrophenyl)-1,3-benzothiazole, InChI=1S/C14H10N2O2S/c1-9-2-7-12-13(8-9)19-14(15-12)10-3-5-11(6-4-10)16(17)18/h2-8H,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)
DOI: 10.21227/h0he-vb08
title: Open Repository for the Evaluation of Ransomware Detection Tools

description: This repository contains the results of running more than 70 samples of ransomware, from different families, dating since 2015. It contains the network traffic (DNS and TCP) and the Input/Output (I/O) operations generated by the malware while encrypting a network shared directory. These data are contained in three files for each ransomware sample: one with the information from the DNS requests, other with the TCP connections another one containing the I/O operations. This information can be useful for testing new and old ransomware detection tools and compare their results.
DOI: 10.15468/r1xujl
title: Species of the Maera - clade collected from Japan. Part 3: genera Maera Leach, 1814, Meximaera Barnard, 1969 and Orientomaera Ariyama, 2018 (addendum), with a key to Japanese species of the clade (Crustacea: Amphipoda: Maeridae)

description: This dataset contains the digitized treatments in Plazi based on the original journal article Ariyama, Hiroyuki (2020): Species of the Maera - clade collected from Japan. Part 3: genera Maera Leach, 1814, Meximaera Barnard, 1969 and Orientomaera Ariyama, 2018 (addendum), with a key to Japanese species of the clade (Crustacea: Amphipoda: Maeridae). Zootaxa 4743 (4): 451-479, DOI: https://doi.org/10.11646/zootaxa.4743.4.1
DOI: 10.21227/z00x-2826
title: Open Repository for the Evaluation of Ransomware Detection Tools

description: This repository contains the results of running more than 70 samples of ransomware, from different families, dating since 2015. It contains the network traffic (DNS and TCP) and the Input/Output (I/O) operations generated by the malware while encrypting a network shared directory. These data are contained in three files for each ransomware sample: one with the information from the DNS requests, other with the TCP connections another one containing the I/O operations. This information can be useful for testing new and old ransomware detection tools and compare their results.