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5-Octyl-1-(p-tolyl)-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
SpectraBase Compound ID 5vCG0ZtshUj
InChI InChI=1S/C21H25NO2S/c1-3-4-5-6-7-8-13-22-20(23)17-14-25-19(18(17)21(22)24)16-11-9-15(2)10-12-16/h9-12,14H,3-8,13H2,1-2H3
InChIKey SILAFHIZDZOKSA-UHFFFAOYSA-N
Mol Weight 355.5 g/mol
Molecular Formula C21H25NO2S
Exact Mass 355.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3RTeXMbphSs
Name 5-Octyl-1-(p-tolyl)-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO2S
InChI InChI=1S/C21H25NO2S/c1-3-4-5-6-7-8-13-22-20(23)17-14-25-19(18(17)21(22)24)16-11-9-15(2)10-12-16/h9-12,14H,3-8,13H2,1-2H3
InChIKey SILAFHIZDZOKSA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201400524
Molecular Weight 355.496 g/mol
SMILES C1(N(C(c2csc(-c3ccc(cc3)C)c12)=O)CCCCCCCC)=O
SPLASH splash10-0a4i-9330000000-faf7c771c1aadbbc8739
Source of Spectrum ASC-356-3761/SM19-7a
Wiley ID 1769767