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1,3-Bis(2-methoxyphenyl)-5-octyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
SpectraBase Compound ID 2kgiIS1K1o0
InChI InChI=1S/C28H31NO4S/c1-4-5-6-7-8-13-18-29-27(30)23-24(28(29)31)26(20-15-10-12-17-22(20)33-3)34-25(23)19-14-9-11-16-21(19)32-2/h9-12,14-17H,4-8,13,18H2,1-3H3
InChIKey IAMPYKAGCSJCLK-UHFFFAOYSA-N
Mol Weight 477.62 g/mol
Molecular Formula C28H31NO4S
Exact Mass 477.19738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9fQK2XUFvs7
Name 1,3-Bis(2-methoxyphenyl)-5-octyl-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H31NO4S
InChI InChI=1S/C28H31NO4S/c1-4-5-6-7-8-13-18-29-27(30)23-24(28(29)31)26(20-15-10-12-17-22(20)33-3)34-25(23)19-14-9-11-16-21(19)32-2/h9-12,14-17H,4-8,13,18H2,1-3H3
InChIKey IAMPYKAGCSJCLK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201400524
Molecular Weight 477.619 g/mol
SMILES C1(=O)c2c(sc(c2C(=O)N1CCCCCCCC)-c1ccccc1OC)-c1ccccc1OC
SPLASH splash10-004i-6002900000-90de6454ce51fb12aa9c
Source of Spectrum ASC-356-3761/SM13-4c
Wiley ID 1769762