cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.14272/ltpvsocpywdifu-uhfffaoysa-n/ir
title: IR (2-(4-methoxyphenyl)ethanamine, InChI=1S/C9H13NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6-7,10H2,1H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 3903, 3853, 3839, 3820, 3805, 3751, 3735, 3710, 3690, 3674, 3649, 3628, 3367, 3289, 3191, 3031, 2997, 2931, 2914, 2834, 2347, 2058, 1945, 1870, 1769, 1751, 1732, 1718, 1700, 1683, 1650, 1636, 1611, 1582, 1558, 1543, 1510, 1463, 1441, 1419, 1375, 1360, 1343, 1320, 1299, 1242, 1177, 1108, 1069, 1033, 860, 816, 754, 725, 713, 700, 637, 560, 520, 472, 422, 411, 398, 387 cm–1.
DOI: 10.14272/pvzckaseqdsyko-uhfffaoysa-n.1
title: C14H20O4
title: InChI=1S/C14H20O4/c1-4-5-6-7-18-11-8-13(16-2)12(10-15)14(9-11)17-3/h8-10H,4-7H2,1-3H3

description: This dataset contains experimental data from a sample (2,6-dimethoxy-4-pentoxybenzaldehyde, InChI=1S/C14H20O4/c1-4-5-6-7-18-11-8-13(16-2)12(10-15)14(9-11)17-3/h8-10H,4-7H2,1-3H3). The datasets from the following experiments are available: infrared absorption spectroscopy (IR)
DOI: 10.14272/pvzckaseqdsyko-uhfffaoysa-n/ir
title: infrared absorption spectroscopy (IR) (2,6-dimethoxy-4-pentoxybenzaldehyde)
title: InChI=1S/C14H20O4/c1-4-5-6-7-18-11-8-13(16-2)12(10-15)14(9-11)17-3/h8-10H,4-7H2,1-3H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3903, 3869, 3852, 3837, 3819, 3803, 3751, 3737, 3711, 3691, 3674, 3649, 3628, 3618, 3587, 3564, 3325, 3118, 3016, 2995, 2953, 2919, 2870, 2857, 2785, 2572, 2533, 2499, 2353, 2091, 1945, 1868, 1732, 1717, 1669, 1638, 1594, 1570, 1509, 1490, 1448, 1424, 1409, 1397, 1377, 1340, 1303, 1248, 1231, 1204, 1196, 1160, 1115, 1061, 1045, 1023, 979, 963, 928, 895, 866, 817, 800, 735, 708, 647, 562, 511, 486, 452, 418, 399 cm–1.
DOI: 10.14272/pwezluvvdhprar-uhfffaoysa-n.1
title: C11H16BrNO
title: InChI=1S/C11H16BrNO/c1-7(2)10-5-9(12)6-11(8(3)4)13(10)14/h5-8H,1-4H3

description: This dataset contains experimental data from a sample (InChI=1S/C11H16BrNO/c1-7(2)10-5-9(12)6-11(8(3)4)13(10)14/h5-8H,1-4H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/pwezluvvdhprar-uhfffaoysa-n/ir
title: IR (, InChI=1S/C11H16BrNO/c1-7(2)10-5-9(12)6-11(8(3)4)13(10)14/h5-8H,1-4H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 3044, 3020, 2961, 2930, 2871, 1733, 1599, 1546, 1462, 1442, 1399, 1362, 1334, 1242, 1211, 1168, 1152, 1107, 1073, 940, 916, 869, 844, 820, 761, 748, 628, 565, 546, 536, 442, 430 cm–1.
DOI: 10.14272/qhkttyodslfkbo-uhfffaoysa-n.3
title: C24H20FN3
title: InChI=1S/C24H20FN3/c25-21-11-13-22(14-12-21)28-24(16-26-27-28)23-15-19-6-5-17-1-3-18(4-2-17)7-9-20(23)10-8-19/h1-4,8,10-16H,5-7,9H2

description: This dataset contains experimental data from a sample (InChI=1S/C24H20FN3/c25-21-11-13-22(14-12-21)28-24(16-26-27-28)23-15-19-6-5-17-1-3-18(4-2-17)7-9-20(23)10-8-19/h1-4,8,10-16H,5-7,9H2).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/qhkttyodslfkbo-uhfffaoysa-n/ir.2
title: IR (, InChI=1S/C24H20FN3/c25-21-11-13-22(14-12-21)28-24(16-26-27-28)23-15-19-6-5-17-1-3-18(4-2-17)7-9-20(23)10-8-19/h1-4,8,10-16H,5-7,9H2)

description: dataset for IR
      
      IR (ATR, ṽ) = 3075, 3030, 3008, 2967, 2924, 2889, 2851, 2359, 1739, 1727, 1597, 1566, 1507, 1478, 1440, 1419, 1368, 1291, 1260, 1217, 1185, 1154, 1136, 1107, 1095, 1052, 1007, 973, 954, 940, 899, 842, 816, 797, 724, 710, 679, 642, 620, 587, 553, 520, 498, 489, 426 cm–1.
DOI: 10.14272/serarprvbwdeba-gxdhufhosa-n.1
title: 2-[(~{E})-(phenylhydrazinylidene)methyl]phenol
title: InChI=1S/C13H12N2O/c16-13-9-5-4-6-11(13)10-14-15-12-7-2-1-3-8-12/h1-10,15-16H/b14-10+

description: This dataset contains experimental data from a sample (2-[(E)-(phenylhydrazinylidene)methyl]phenol, InChI=1S/C13H12N2O/c16-13-9-5-4-6-11(13)10-14-15-12-7-2-1-3-8-12/h1-10,15-16H/b14-10+). The datasets from the following experiments are available: infrared absorption spectroscopy (IR)
DOI: 10.14272/serarprvbwdeba-gxdhufhosa-n/ir
title: infrared absorption spectroscopy (IR) (2-[(E)-(phenylhydrazinylidene)methyl]phenol)
title: InChI=1S/C13H12N2O/c16-13-9-5-4-6-11(13)10-14-15-12-7-2-1-3-8-12/h1-10,15-16H/b14-10+

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3901, 3853, 3836, 3820, 3802, 3748, 3735, 3711, 3687, 3672, 3648, 3628, 3615, 3588, 3567, 3315, 3047, 3031, 3012, 2349, 1942, 1922, 1830, 1769, 1748, 1735, 1715, 1700, 1684, 1655, 1638, 1619, 1596, 1587, 1565, 1560, 1541, 1521, 1489, 1475, 1458, 1446, 1418, 1380, 1357, 1336, 1319, 1298, 1271, 1252, 1224, 1205, 1176, 1145, 1106, 1072, 1030, 992, 972, 943, 919, 868, 822, 762, 741, 704, 688, 652, 633, 615, 561, 506, 477, 419, 397, 384 cm–1.
DOI: 10.14272/uutghmjizsvfhg-uhfffaoysa-n.1
title: 1,3-dithian-2-yl(phenyl)methanone
title: InChI=1S/C11H12OS2/c12-10(9-5-2-1-3-6-9)11-13-7-4-8-14-11/h1-3,5-6,11H,4,7-8H2

description: This dataset contains experimental data from a sample (1,3-dithian-2-yl(phenyl)methanone, InChI=1S/C11H12OS2/c12-10(9-5-2-1-3-6-9)11-13-7-4-8-14-11/h1-3,5-6,11H,4,7-8H2).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/uutghmjizsvfhg-uhfffaoysa-n/ir
title: IR (1,3-dithian-2-yl(phenyl)methanone, InChI=1S/C11H12OS2/c12-10(9-5-2-1-3-6-9)11-13-7-4-8-14-11/h1-3,5-6,11H,4,7-8H2)

description: dataset for IR
      
      IR (ATR, ṽ) = 3052, 2971, 2951, 2936, 2926, 2902, 2361, 2341, 1739, 1727, 1666, 1643, 1593, 1578, 1548, 1446, 1419, 1409, 1366, 1350, 1321, 1274, 1246, 1207, 1179, 1156, 1146, 1103, 1077, 997, 909, 812, 795, 765, 718, 685, 653, 642, 630, 479, 461, 426 cm–1.
DOI: 10.14272/weqobxhukdtnqy-uhfffaoysa-n.2
title: 4-ethoxy-2-hydroxy-6-methoxybenzaldehyde
title: InChI=1S/C10H12O4/c1-3-14-7-4-9(12)8(6-11)10(5-7)13-2/h4-6,12H,3H2,1-2H3

description: This dataset contains experimental data from a sample (4-ethoxy-2-hydroxy-6-methoxybenzaldehyde, InChI=1S/C10H12O4/c1-3-14-7-4-9(12)8(6-11)10(5-7)13-2/h4-6,12H,3H2,1-2H3). The datasets from the following experiments are available: infrared absorption spectroscopy (IR)
DOI: 10.14272/weqobxhukdtnqy-uhfffaoysa-n/ir.1
title: infrared absorption spectroscopy (IR) (4-ethoxy-2-hydroxy-6-methoxybenzaldehyde)
title: InChI=1S/C10H12O4/c1-3-14-7-4-9(12)8(6-11)10(5-7)13-2/h4-6,12H,3H2,1-2H3

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3747, 3733, 3686, 3676, 3649, 3616, 3565, 3085, 3009, 2992, 2976, 2946, 2928, 2898, 2873, 2853, 2741, 2347, 1926, 1870, 1747, 1734, 1718, 1698, 1681, 1638, 1609, 1582, 1543, 1507, 1499, 1466, 1455, 1426, 1398, 1375, 1367, 1332, 1296, 1220, 1198, 1167, 1118, 1045, 1017, 967, 881, 846, 812, 732, 694, 662, 637, 540, 518, 470, 418, 398, 387 cm–1.
DOI: 10.14272/wqflltdmtnware-uhfffaoysa-n.1
title: C25H23N3
title: InChI=1S/C25H23N3/c1-18-2-14-23(15-3-18)28-25(17-26-27-28)24-16-21-9-8-19-4-6-20(7-5-19)10-12-22(24)13-11-21/h2-7,11,13-17H,8-10,12H2,1H3

description: This dataset contains experimental data from a sample (InChI=1S/C25H23N3/c1-18-2-14-23(15-3-18)28-25(17-26-27-28)24-16-21-9-8-19-4-6-20(7-5-19)10-12-22(24)13-11-21/h2-7,11,13-17H,8-10,12H2,1H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/wqflltdmtnware-uhfffaoysa-n/ir
title: IR (, InChI=1S/C25H23N3/c1-18-2-14-23(15-3-18)28-25(17-26-27-28)24-16-21-9-8-19-4-6-20(7-5-19)10-12-22(24)13-11-21/h2-7,11,13-17H,8-10,12H2,1H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 3014, 2969, 2926, 2895, 2855, 2357, 1739, 1727, 1588, 1552, 1513, 1501, 1440, 1423, 1413, 1376, 1366, 1230, 1217, 1207, 1111, 1089, 1052, 1007, 973, 907, 840, 832, 818, 793, 712, 675, 642, 583, 557, 516, 495, 436, 412 cm–1.
DOI: 10.14272/zjxhvysdmukuca-uhfffaoysa-n/ir
title: IR (tert-butyl 3-aminopropanoate, InChI=1S/C7H15NO2/c1-7(2,3)10-6(9)4-5-8/h4-5,8H2,1-3H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 3903, 3853, 3836, 3818, 3803, 3751, 3734, 3710, 3690, 3674, 3649, 3629, 3564, 3291, 2972, 2929, 2911, 2876, 2782, 2710, 2636, 2618, 2504, 2351, 2245, 2203, 1868, 1724, 1646, 1630, 1558, 1506, 1475, 1465, 1448, 1414, 1384, 1367, 1332, 1292, 1258, 1153, 1061, 989, 945, 919, 885, 841, 793, 751, 698, 650, 572, 528, 459, 429, 398 cm–1.
DOI: 10.14272/vbnpdzxlfvdvsz-uhfffaoysa-n.1
title: C14H23NO
title: InChI=1S/C14H23NO/c1-5-10(3)13-7-12(9-16)8-14(15-13)11(4)6-2/h7-8,10-11,16H,5-6,9H2,1-4H3

description: This dataset contains experimental data from a sample (InChI=1S/C14H23NO/c1-5-10(3)13-7-12(9-16)8-14(15-13)11(4)6-2/h7-8,10-11,16H,5-6,9H2,1-4H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/vbnpdzxlfvdvsz-uhfffaoysa-n/ir
title: IR (, InChI=1S/C14H23NO/c1-5-10(3)13-7-12(9-16)8-14(15-13)11(4)6-2/h7-8,10-11,16H,5-6,9H2,1-4H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 2961, 2930, 2873, 2367, 1739, 1727, 1631, 1607, 1566, 1529, 1460, 1454, 1421, 1376, 1201, 1162, 1136, 1060, 1009, 962, 928, 911, 856, 785, 756, 614, 583, 557, 532 cm–1.
DOI: 10.14272/vtrfayhjkskhgy-uhfffaoysa-n.1
title: 4-bromo-2,6-dimethylpyridine
title: InChI=1S/C7H8BrN/c1-5-3-7(8)4-6(2)9-5/h3-4H,1-2H3

description: This dataset contains experimental data from a sample (4-bromo-2,6-dimethylpyridine, InChI=1S/C7H8BrN/c1-5-3-7(8)4-6(2)9-5/h3-4H,1-2H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/vtrfayhjkskhgy-uhfffaoysa-n/ir
title: IR (4-bromo-2,6-dimethylpyridine, InChI=1S/C7H8BrN/c1-5-3-7(8)4-6(2)9-5/h3-4H,1-2H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 2922, 2351, 1739, 1725, 1713, 1562, 1450, 1405, 1393, 1272, 1228, 1207, 1109, 1028, 842, 803, 716, 565, 532, 455 cm–1.
DOI: 10.14272/vxuudtwougaroa-uhfffaoysa-n.2
title: C25H23N3
title: InChI=1S/C25H23N3/c1-2-4-22(5-3-1)18-28-25(17-26-27-28)24-16-21-11-10-19-6-8-20(9-7-19)12-14-23(24)15-13-21/h1-9,13,15-17H,10-12,14,18H2

description: This dataset contains experimental data from a sample (InChI=1S/C25H23N3/c1-2-4-22(5-3-1)18-28-25(17-26-27-28)24-16-21-11-10-19-6-8-20(9-7-19)12-14-23(24)15-13-21/h1-9,13,15-17H,10-12,14,18H2).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/vxuudtwougaroa-uhfffaoysa-n/ir.1
title: IR (, InChI=1S/C25H23N3/c1-2-4-22(5-3-1)18-28-25(17-26-27-28)24-16-21-11-10-19-6-8-20(9-7-19)12-14-23(24)15-13-21/h1-9,13,15-17H,10-12,14,18H2)

description: dataset for IR
      
      IR (ATR, ṽ) = 3026, 3010, 2953, 2924, 2889, 2851, 1739, 1727, 1595, 1497, 1478, 1454, 1436, 1413, 1358, 1334, 1303, 1240, 1213, 1183, 1158, 1115, 1109, 1093, 1075, 1036, 981, 950, 907, 842, 795, 728, 720, 710, 695, 671, 644, 599, 577, 518, 495, 471 cm–1.
DOI: 10.14272/ypkvbmwynzemps-uhfffaoysa-n.1
title: 1-(1,3-dithian-2-yl)ethanol
title: InChI=1S/C6H12OS2/c1-5(7)6-8-3-2-4-9-6/h5-7H,2-4H2,1H3

description: This dataset contains experimental data from a sample (1-(1,3-dithian-2-yl)ethanol, InChI=1S/C6H12OS2/c1-5(7)6-8-3-2-4-9-6/h5-7H,2-4H2,1H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/ypkvbmwynzemps-uhfffaoysa-n/ir
title: IR (1-(1,3-dithian-2-yl)ethanol, InChI=1S/C6H12OS2/c1-5(7)6-8-3-2-4-9-6/h5-7H,2-4H2,1H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 3424, 2971, 2928, 2895, 2828, 1739, 1727, 1450, 1421, 1368, 1274, 1246, 1217, 1175, 1117, 1075, 1054, 1028, 1001, 944, 907, 875, 844, 787, 716, 681, 657, 551, 485, 477, 442, 424 cm–1.
DOI: 10.14272/arxutdupdpthbh-uhfffaoysa-n.1
title: C19H20O3S2
title: InChI=1S/C19H20O3S2/c1-21-16-10-8-15(9-11-16)18(20)22-17(14-6-3-2-4-7-14)19-23-12-5-13-24-19/h2-4,6-11,17,19H,5,12-13H2,1H3

description: This dataset contains experimental data from a sample (InChI=1S/C19H20O3S2/c1-21-16-10-8-15(9-11-16)18(20)22-17(14-6-3-2-4-7-14)19-23-12-5-13-24-19/h2-4,6-11,17,19H,5,12-13H2,1H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/arxutdupdpthbh-uhfffaoysa-n/ir
title: IR (, InChI=1S/C19H20O3S2/c1-21-16-10-8-15(9-11-16)18(20)22-17(14-6-3-2-4-7-14)19-23-12-5-13-24-19/h2-4,6-11,17,19H,5,12-13H2,1H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 3059, 3028, 3014, 2969, 2944, 2932, 2908, 2895, 2836, 2355, 1737, 1723, 1699, 1605, 1576, 1511, 1495, 1454, 1436, 1423, 1325, 1303, 1260, 1197, 1170, 1117, 1101, 1048, 1024, 1009, 956, 909, 848, 830, 791, 767, 756, 720, 695, 669, 632, 612, 567, 512, 498, 442 cm–1.
DOI: 10.14272/gfwphxlfiuzhab-cyoizwbssa-n.1
title: C27H40N4O5
title: InChI=1S/C27H40N4O5/c1-7-16(2)22-26(35)31-14-8-9-21(31)25(34)28-17(3)23(32)29-20(24(33)30-22)15-18-10-12-19(13-11-18)36-27(4,5)6/h10-13,16-17,20-22H,7-9,14-15H2,1-6H3,(H,28,34)(H,29,32)(H,30,33)/t16-,17+,20+,21-,22+/m1/s1

description: This dataset contains experimental data from a sample (InChI=1S/C27H40N4O5/c1-7-16(2)22-26(35)31-14-8-9-21(31)25(34)28-17(3)23(32)29-20(24(33)30-22)15-18-10-12-19(13-11-18)36-27(4,5)6/h10-13,16-17,20-22H,7-9,14-15H2,1-6H3,(H,28,34)(H,29,32)(H,30,33)/t16-,17+,20+,21-,22+/m1/s1). The datasets from the following experiments are available: infrared absorption spectroscopy (IR)
DOI: 10.14272/gfwphxlfiuzhab-cyoizwbssa-n/ir
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C27H40N4O5/c1-7-16(2)22-26(35)31-14-8-9-21(31)25(34)28-17(3)23(32)29-20(24(33)30-22)15-18-10-12-19(13-11-18)36-27(4,5)6/h10-13,16-17,20-22H,7-9,14-15H2,1-6H3,(H,28,34)(H,29,32)(H,30,33)/t16-,17+,20+,21-,22+/m1/s1

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3285, 2969, 2928, 2879, 2363, 1739, 1727, 1688, 1658, 1643, 1631, 1619, 1611, 1564, 1548, 1527, 1511, 1503, 1462, 1444, 1415, 1378, 1366, 1258, 1232, 1217, 1201, 1160, 1136, 1103, 1028, 897, 801, 720, 669, 542, 514, 414 cm–1.
DOI: 10.14272/kzlzbbzticqzfv-cmphsymrsa-n.1
title: C25H42O2Si
title: InChI=1S/C25H42O2Si/c1-23(2,3)28(6,7)27-18-12-14-24(4)17(16-18)8-9-19-20-10-11-22(26)25(20,5)15-13-21(19)24/h10,17-19,21H,8-9,11-16H2,1-7H3/t17-,18-,19-,21-,24-,25-/m0/s1

description: This dataset contains experimental data from a sample ((3S,5S,8R,9S,10S,13S)-3-[tert-butyl(dimethyl)silyl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,16-dodecahydrocyclopenta[a]phenanthren-17-one, InChI=1S/C25H42O2Si/c1-23(2,3)28(6,7)27-18-12-14-24(4)17(16-18)8-9-19-20-10-11-22(26)25(20,5)15-13-21(19)24/h10,17-19,21H,8-9,11-16H2,1-7H3/t17-,18-,19-,21-,24-,25-/m0/s1). The datasets from the following experiments are available: infrared absorption spectroscopy (IR)
DOI: 10.14272/ngisomrmyxkggn-uhfffaoysa-n.1
title: 4-bromo-2,6-dimethyl-1-oxidopyridin-1-ium
title: InChI=1S/C7H8BrNO/c1-5-3-7(8)4-6(2)9(5)10/h3-4H,1-2H3

description: This dataset contains experimental data from a sample (4-bromo-2,6-dimethyl-1-oxidopyridin-1-ium, InChI=1S/C7H8BrNO/c1-5-3-7(8)4-6(2)9(5)10/h3-4H,1-2H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/ngisomrmyxkggn-uhfffaoysa-n/ir
title: IR (4-bromo-2,6-dimethyl-1-oxidopyridin-1-ium, InChI=1S/C7H8BrNO/c1-5-3-7(8)4-6(2)9(5)10/h3-4H,1-2H3)

description: dataset for IR
      
      IR (ATR, ṽ) = 3059, 3038, 3002, 2969, 2955, 2924, 2908, 2363, 1739, 1725, 1711, 1607, 1554, 1454, 1421, 1385, 1370, 1274, 1242, 1128, 1105, 1034, 995, 897, 873, 860, 852, 750, 716, 597, 557, 538, 451 cm–1.
DOI: 10.14272/kzlzbbzticqzfv-cmphsymrsa-n/ir
title: infrared absorption spectroscopy (IR) ((3S,5S,8R,9S,10S,13S)-3-[tert-butyl(dimethyl)silyl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,16-dodecahydrocyclopenta[a]phenanthren-17-one)
title: InChI=1S/C25H42O2Si/c1-23(2,3)28(6,7)27-18-12-14-24(4)17(16-18)8-9-19-20-10-11-22(26)25(20,5)15-13-21(19)24/h10,17-19,21H,8-9,11-16H2,1-7H3/t17-,18-,19-,21-,24-,25-/m0/s1

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3344, 2928, 2885, 2855, 1739, 1713, 1462, 1450, 1405, 1376, 1360, 1293, 1252, 1201, 1175, 1146, 1132, 1113, 1083, 1068, 1058, 1036, 1007, 981, 964, 940, 905, 869, 854, 834, 816, 773, 695, 669, 650, 622, 587, 573, 546, 534, 412 cm–1.
DOI: 10.14272/llklznnyrpuema-ctadllllsa-n.1
title: C36H44ClFN2O7
title: InChI=1S/C36H44ClFN2O7/c1-19(2)25-15-6-20(3)16-30(25)47-34(42)27-18-29(36(44)46-5)40(32(27)22-9-13-24(38)14-10-22)33(41)26-17-28(35(43)45-4)39-31(26)21-7-11-23(37)12-8-21/h7-14,19-20,25-32,39H,6,15-18H2,1-5H3/t20-,25+,26-,27+,28-,29+,30-,31-,32+/m1/s1

description: This dataset contains experimental data from a sample (InChI=1S/C36H44ClFN2O7/c1-19(2)25-15-6-20(3)16-30(25)47-34(42)27-18-29(36(44)46-5)40(32(27)22-9-13-24(38)14-10-22)33(41)26-17-28(35(43)45-4)39-31(26)21-7-11-23(37)12-8-21/h7-14,19-20,25-32,39H,6,15-18H2,1-5H3/t20-,25+,26-,27+,28-,29+,30-,31-,32+/m1/s1).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/llklznnyrpuema-ctadllllsa-n/ir
title: IR (, InChI=1S/C36H44ClFN2O7/c1-19(2)25-15-6-20(3)16-30(25)47-34(42)27-18-29(36(44)46-5)40(32(27)22-9-13-24(38)14-10-22)33(41)26-17-28(35(43)45-4)39-31(26)21-7-11-23(37)12-8-21/h7-14,19-20,25-32,39H,6,15-18H2,1-5H3/t20-,25+,26-,27+,28-,29+,30-,31-,32+/m1/s1)

description: dataset for IR
      
      IR (ATR, ṽ) = 2953, 2928, 2871, 2360, 1732, 1647, 1605, 1510, 1434, 1370, 1295, 1248, 1227, 1197, 1174, 1091, 1013, 953, 914, 840, 823, 744, 730, 555, 517, 418, 385 cm–1.
DOI: 10.14272/uvvmcszegirabd-ijtctnlasa-n.1
title: C49H56BrClFN3O10
title: InChI=1S/C49H56BrClFN3O10/c1-25(2)33-20-7-26(3)21-40(33)65-46(58)36-24-39(49(61)64-6)55(43(36)29-12-18-32(52)19-13-29)45(57)35-23-38(48(60)63-5)54(42(35)28-10-16-31(51)17-11-28)44(56)34-22-37(47(59)62-4)53-41(34)27-8-14-30(50)15-9-27/h8-19,25-26,33-43,53H,7,20-24H2,1-6H3/t26-,33+,34+,35-,36+,37+,38-,39+,40-,41+,42-,43+/m1/s1

description: This dataset contains experimental data from a sample (InChI=1S/C49H56BrClFN3O10/c1-25(2)33-20-7-26(3)21-40(33)65-46(58)36-24-39(49(61)64-6)55(43(36)29-12-18-32(52)19-13-29)45(57)35-23-38(48(60)63-5)54(42(35)28-10-16-31(51)17-11-28)44(56)34-22-37(47(59)62-4)53-41(34)27-8-14-30(50)15-9-27/h8-19,25-26,33-43,53H,7,20-24H2,1-6H3/t26-,33+,34+,35-,36+,37+,38-,39+,40-,41+,42-,43+/m1/s1).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/uvvmcszegirabd-ijtctnlasa-n/ir
title: IR (, InChI=1S/C49H56BrClFN3O10/c1-25(2)33-20-7-26(3)21-40(33)65-46(58)36-24-39(49(61)64-6)55(43(36)29-12-18-32(52)19-13-29)45(57)35-23-38(48(60)63-5)54(42(35)28-10-16-31(51)17-11-28)44(56)34-22-37(47(59)62-4)53-41(34)27-8-14-30(50)15-9-27/h8-19,25-26,33-43,53H,7,20-24H2,1-6H3/t26-,33+,34+,35-,36+,37+,38-,39+,40-,41+,42-,43+/m1/s1)

description: dataset for IR
      
      IR (ATR, ṽ) = 2952, 2928, 2868, 2360, 1737, 1655, 1606, 1510, 1492, 1434, 1417, 1368, 1249, 1228, 1200, 1173, 1091, 1011, 952, 839, 823, 745, 718, 541, 520, 497, 459, 418 cm–1.
DOI: 10.14272/wdifergupsxyrv-dytptglasa-n.1
title: C39H46ClFN2O8
title: InChI=1S/C39H46ClFN2O8/c1-7-33(44)42-30(38(47)49-5)19-28(34(42)23-9-13-25(40)14-10-23)36(45)43-31(39(48)50-6)20-29(35(43)24-11-15-26(41)16-12-24)37(46)51-32-18-22(4)8-17-27(32)21(2)3/h7,9-16,21-22,27-32,34-35H,1,8,17-20H2,2-6H3/t22-,27+,28-,29+,30-,31+,32-,34-,35+/m1/s1

description: This dataset contains experimental data from a sample (InChI=1S/C39H46ClFN2O8/c1-7-33(44)42-30(38(47)49-5)19-28(34(42)23-9-13-25(40)14-10-23)36(45)43-31(39(48)50-6)20-29(35(43)24-11-15-26(41)16-12-24)37(46)51-32-18-22(4)8-17-27(32)21(2)3/h7,9-16,21-22,27-32,34-35H,1,8,17-20H2,2-6H3/t22-,27+,28-,29+,30-,31+,32-,34-,35+/m1/s1).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/wdifergupsxyrv-dytptglasa-n/ir
title: IR (, InChI=1S/C39H46ClFN2O8/c1-7-33(44)42-30(38(47)49-5)19-28(34(42)23-9-13-25(40)14-10-23)36(45)43-31(39(48)50-6)20-29(35(43)24-11-15-26(41)16-12-24)37(46)51-32-18-22(4)8-17-27(32)21(2)3/h7,9-16,21-22,27-32,34-35H,1,8,17-20H2,2-6H3/t22-,27+,28-,29+,30-,31+,32-,34-,35+/m1/s1)

description: dataset for IR
      
      IR (ATR, ṽ) = 2953, 2928, 2871, 2364, 1740, 1655, 1616, 1510, 1492, 1415, 1364, 1249, 1228, 1200, 1173, 1091, 1013, 977, 950, 914, 904, 843, 824, 798, 608, 555, 520, 497, 458, 418 cm–1.
DOI: 10.14272/xugfxwhzqiuncq-uhfffaoysa-n.1
title: C11H16N2O3
title: InChI=1S/C11H16N2O3/c1-7(2)10-5-9(13(15)16)6-11(8(3)4)12(10)14/h5-8H,1-4H3

description: This dataset contains experimental data from a sample (InChI=1S/C11H16N2O3/c1-7(2)10-5-9(13(15)16)6-11(8(3)4)12(10)14/h5-8H,1-4H3).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.17632/8fwxgv873j.1
title: Data for: Characteristics and sources of organic carbon in coastal and marine atmospheric particulates over East China

description: These are the raw data analyzed in this article.
DOI: 10.14272/bbpgylpedpnifs-uhfffaoysa-n.1
title: 1,3-dithian-2-yl(phenyl)methanol
title: InChI=1S/C11H14OS2/c12-10(9-5-2-1-3-6-9)11-13-7-4-8-14-11/h1-3,5-6,10-12H,4,7-8H2

description: This dataset contains experimental data from a sample (1,3-dithian-2-yl(phenyl)methanol, InChI=1S/C11H14OS2/c12-10(9-5-2-1-3-6-9)11-13-7-4-8-14-11/h1-3,5-6,10-12H,4,7-8H2).
      The datasets from the following experiments are available:
      
      IR
DOI: 10.14272/bbpgylpedpnifs-uhfffaoysa-n/ir
title: IR (1,3-dithian-2-yl(phenyl)methanol, InChI=1S/C11H14OS2/c12-10(9-5-2-1-3-6-9)11-13-7-4-8-14-11/h1-3,5-6,10-12H,4,7-8H2)

description: dataset for IR
      
      IR (ATR, ṽ) = 3415, 3328, 3059, 3022, 2942, 2893, 2861, 2818, 2361, 2325, 1754, 1737, 1727, 1601, 1493, 1450, 1429, 1417, 1385, 1329, 1303, 1276, 1244, 1217, 1199, 1175, 1089, 1056, 1034, 1017, 1001, 991, 956, 905, 873, 844, 824, 793, 765, 740, 720, 693, 655, 622, 612, 591, 530, 491, 463 cm–1.
DOI: 10.14272/gkwheypzkoerdi-iibwnchysa-n.1
title: C54H40N6O4
title: InChI=1S/C54H40N6O4/c1-3-63-53(61)33-9-5-31(6-10-33)49-41-17-21-45(57-41)51(37-13-15-39-35(29-37)25-27-55-39)47-23-19-43(59-47)50(32-7-11-34(12-8-32)54(62)64-4-2)44-20-24-48(60-44)52(46-22-18-42(49)58-46)38-14-16-40-36(30-38)26-28-56-40/h5-30,55-57,60H,3-4H2,1-2H3/b49-41-,49-42-,50-43-,50-44-,51-45-,51-47-,52-46-,52-48-

description: This dataset contains experimental data from a sample (InChI=1S/C54H40N6O4/c1-3-63-53(61)33-9-5-31(6-10-33)49-41-17-21-45(57-41)51(37-13-15-39-35(29-37)25-27-55-39)47-23-19-43(59-47)50(32-7-11-34(12-8-32)54(62)64-4-2)44-20-24-48(60-44)52(46-22-18-42(49)58-46)38-14-16-40-36(30-38)26-28-56-40/h5-30,55-57,60H,3-4H2,1-2H3/b49-41-,49-42-,50-43-,50-44-,51-45-,51-47-,52-46-,52-48-). The datasets from the following experiments are available: infrared absorption spectroscopy (IR)
DOI: 10.14272/gkwheypzkoerdi-iibwnchysa-n/ir
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C54H40N6O4/c1-3-63-53(61)33-9-5-31(6-10-33)49-41-17-21-45(57-41)51(37-13-15-39-35(29-37)25-27-55-39)47-23-19-43(59-47)50(32-7-11-34(12-8-32)54(62)64-4-2)44-20-24-48(60-44)52(46-22-18-42(49)58-46)38-14-16-40-36(30-38)26-28-56-40/h5-30,55-57,60H,3-4H2,1-2H3/b49-41-,49-42-,50-43-,50-44-,51-45-,51-47-,52-46-,52-48-

description: dataset for infrared absorption spectroscopy (IR) IR (ATR, ṽ) = 3381, 3320, 2922, 2856, 1698, 1602, 1560, 1463, 1421, 1402, 1368, 1344, 1309, 1290, 1278, 1247, 1225, 1191, 1177, 1157, 1112, 1098, 1069, 1024, 1000, 983, 970, 925, 892, 873, 849, 802, 783, 762, 727, 705, 657, 630, 582, 545, 526, 489, 441, 414 cm–1.
DOI: 10.14272/kuogvdskrxzpej-uhfffaoysa-n.1
title: C61H35N7OS
title: InChI=1S/C61H35N7OS/c62-36-45-56(65-46-26-9-1-18-37(46)38-19-2-10-27-47(38)65)55(61-64-63-60(69-61)54-34-17-35-70-54)58(67-50-30-13-5-22-41(50)42-23-6-14-31-51(42)67)59(68-52-32-15-7-24-43(52)44-25-8-16-33-53(44)68)57(45)66-48-28-11-3-20-39(48)40-21-4-12-29-49(40)66/h1-35H

description: This dataset contains experimental data from a sample (2,3,4,6-tetra(carbazol-9-yl)-5-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzonitrile, InChI=1S/C61H35N7OS/c62-36-45-56(65-46-26-9-1-18-37(46)38-19-2-10-27-47(38)65)55(61-64-63-60(69-61)54-34-17-35-70-54)58(67-50-30-13-5-22-41(50)42-23-6-14-31-51(42)67)59(68-52-32-15-7-24-43(52)44-25-8-16-33-53(44)68)57(45)66-48-28-11-3-20-39(48)40-21-4-12-29-49(40)66/h1-35H). The datasets from the following experiments are available: infrared absorption spectroscopy (IR)