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3-(Diethoxyphosphorylthio)-3'-ethylthio-4,4',5,5'-tetraphenyl-2,2'-dithienyl
SpectraBase Compound ID 8dOhCCba9SG
InChI InChI=1S/C38H35O3PS4/c1-4-40-42(39,41-5-2)46-36-32(28-21-13-8-14-22-28)34(30-25-17-10-18-26-30)45-38(36)37-35(43-6-3)31(27-19-11-7-12-20-27)33(44-37)29-23-15-9-16-24-29/h7-26H,4-6H2,1-3H3
InChIKey ZBNRPBFWDZJNFE-UHFFFAOYSA-N
Mol Weight 698.9 g/mol
Molecular Formula C38H35O3PS4
Exact Mass 698.120667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YlBDzBxBaG
Name 3-(Diethoxyphosphorylthio)-3'-ethylthio-4,4',5,5'-tetraphenyl-2,2'-dithienyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H35O3PS4
InChI InChI=1S/C38H35O3PS4/c1-4-40-42(39,41-5-2)46-36-32(28-21-13-8-14-22-28)34(30-25-17-10-18-26-30)45-38(36)37-35(43-6-3)31(27-19-11-7-12-20-27)33(44-37)29-23-15-9-16-24-29/h7-26H,4-6H2,1-3H3
InChIKey ZBNRPBFWDZJNFE-UHFFFAOYSA-N
Molecular Weight 698.909 g/mol
SMILES c1(-c2c(c(-c3ccccc3)c(s2)-c2ccccc2)SCC)c(c(-c2ccccc2)c(s1)-c1ccccc1)SP(=O)(OCC)OCC
SPLASH splash10-0f6t-0000089200-4456db1555d9ee135cc6
Source of Spectrum F-53-7523-34
Synonyms 3-Ethoxy-3-{2-[3-(ethylsulfanyl)-4,5-diphenylthiophen-2-yl]-4,5-diphenylthiophen-3-yl}-1,4-dioxa-3-thia-2-phosphahex-1-en-2-yn-1-one
Wiley ID 802385