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6-Octyl-1,3-di(thiophen-2-yl)-5H-thieno[3,4-f]isoindole-5,7(6H)-dione
SpectraBase Compound ID xwgwW1zTCE
InChI InChI=1S/C26H25NO2S3/c1-2-3-4-5-6-7-12-27-25(28)19-15-17-18(16-20(19)26(27)29)24(22-11-9-14-31-22)32-23(17)21-10-8-13-30-21/h8-11,13-16H,2-7,12H2,1H3
InChIKey BGZIXCZRFIIMFP-UHFFFAOYSA-N
Mol Weight 479.67 g/mol
Molecular Formula C26H25NO2S3
Exact Mass 479.104743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtsQpVGU9eT
Name 6-Octyl-1,3-di(thiophen-2-yl)-5H-thieno[3,4-f]isoindole-5,7(6H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25NO2S3
InChI InChI=1S/C26H25NO2S3/c1-2-3-4-5-6-7-12-27-25(28)19-15-17-18(16-20(19)26(27)29)24(22-11-9-14-31-22)32-23(17)21-10-8-13-30-21/h8-11,13-16H,2-7,12H2,1H3
InChIKey BGZIXCZRFIIMFP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201700762
Molecular Weight 479.671 g/mol
SMILES c1(sccc1)-c1c2cc3C(N(C(c3cc2c(s1)-c1cccs1)=O)CCCCCCCC)=O
SPLASH splash10-0a59-9000200000-d1f31cd557a310913106
Source of Spectrum ASC-359-3813-3i
Wiley ID 1811544