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5-Hexyl-1,3-bis(2-methoxyphenyl)-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
SpectraBase Compound ID AEMGXR1gpDQ
InChI InChI=1S/C26H27NO4S/c1-4-5-6-11-16-27-25(28)21-22(26(27)29)24(18-13-8-10-15-20(18)31-3)32-23(21)17-12-7-9-14-19(17)30-2/h7-10,12-15H,4-6,11,16H2,1-3H3
InChIKey NFNXSQFBFUZHEB-UHFFFAOYSA-N
Mol Weight 449.57 g/mol
Molecular Formula C26H27NO4S
Exact Mass 449.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTPKdYlQMI3
Name 5-Hexyl-1,3-bis(2-methoxyphenyl)-4H-thieno[3,4-c]pyrrole-4,6(5H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO4S
InChI InChI=1S/C26H27NO4S/c1-4-5-6-11-16-27-25(28)21-22(26(27)29)24(18-13-8-10-15-20(18)31-3)32-23(21)17-12-7-9-14-19(17)30-2/h7-10,12-15H,4-6,11,16H2,1-3H3
InChIKey NFNXSQFBFUZHEB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201400524
Molecular Weight 449.565 g/mol
SMILES C1(=O)c2c(sc(c2C(=O)N1CCCCCC)-c1ccccc1OC)-c1ccccc1OC
SPLASH splash10-052b-3002900000-2f978862f9a2170c61d3
Source of Spectrum ASC-356-3761/SM9-3h
Wiley ID 1769756