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2,8-Bis(benzylsulfanyl)dibenzothiophene
SpectraBase Compound ID LCv15UAdoz
InChI InChI=1S/C26H20S3/c1-3-7-19(8-4-1)17-27-21-11-13-25-23(15-21)24-16-22(12-14-26(24)29-25)28-18-20-9-5-2-6-10-20/h1-16H,17-18H2
InChIKey QAFRNFQHCWZWSC-UHFFFAOYSA-N
Mol Weight 428.63 g/mol
Molecular Formula C26H20S3
Exact Mass 428.072714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4RK089zu4Be
Name 2,8-Bis(benzylsulfanyl)dibenzothiophene
CAS Registry Number 113525-39-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H20S3
InChI InChI=1S/C26H20S3/c1-3-7-19(8-4-1)17-27-21-11-13-25-23(15-21)24-16-22(12-14-26(24)29-25)28-18-20-9-5-2-6-10-20/h1-16H,17-18H2
InChIKey QAFRNFQHCWZWSC-UHFFFAOYSA-N
Molecular Weight 428.626 g/mol
SMILES c12sc3c(c2cc(SCc2ccccc2)cc1)cc(cc3)SCc1ccccc1
SPLASH splash10-01ti-0069800000-b50d6eab7ba4236f637f
Source of Spectrum Y-24-754-27
Synonyms 2,8-Bis(benzylthio)dibenzothiophene 2,8-Bis(phenylmethylsulfanyl)dibenzothiophene 2,8-Bis(phenylmethylthio)dibenzothiophene
Wiley ID 1380774