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3-Benzylthio-2-(2,2-bis(benzylthio)ethyl)benzo[b]thiophene
SpectraBase Compound ID 9fi7opHLRwR
InChI InChI=1S/C31H28S4/c1-4-12-24(13-5-1)21-32-30(33-22-25-14-6-2-7-15-25)20-29-31(27-18-10-11-19-28(27)35-29)34-23-26-16-8-3-9-17-26/h1-19,30H,20-23H2
InChIKey MGBQEGDURYNUIQ-UHFFFAOYSA-N
Mol Weight 528.8 g/mol
Molecular Formula C31H28S4
Exact Mass 528.107386 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3w8FuMcjDwt
Name 3-Benzylthio-2-(2,2-bis(benzylthio)ethyl)benzo[b]thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H28S4
InChI InChI=1S/C31H28S4/c1-4-12-24(13-5-1)21-32-30(33-22-25-14-6-2-7-15-25)20-29-31(27-18-10-11-19-28(27)35-29)34-23-26-16-8-3-9-17-26/h1-19,30H,20-23H2
InChIKey MGBQEGDURYNUIQ-UHFFFAOYSA-N
Molecular Weight 528.805 g/mol
SMILES c1(c(c2ccccc2s1)SCc1ccccc1)CC(SCc1ccccc1)SCc1ccccc1
SPLASH splash10-052f-8193200000-5b45fab550f67c2b783e
Source of Spectrum F-53-7519-22
Synonyms 3-(benzylsulfanyl)-2-[2,2-bis(benzylsulfanyl)ethyl]-1-benzothiophene
Wiley ID 802398