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2-[(Phenylsulfonyl)methyl]-1,4-benzodithiin
SpectraBase Compound ID JFdXmtedTYU
InChI InChI=1S/C15H12O2S3/c16-20(17,13-6-2-1-3-7-13)11-12-10-18-14-8-4-5-9-15(14)19-12/h1-10H,11H2
InChIKey WPBSVXPYDMOVTM-UHFFFAOYSA-N
Mol Weight 320.44 g/mol
Molecular Formula C15H12O2S3
Exact Mass 319.999943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lJr721AFpJ
Name 2-[(Phenylsulfonyl)methyl]-1,4-benzodithiin
CAS Registry Number 138286-98-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12O2S3
InChI InChI=1S/C15H12O2S3/c16-20(17,13-6-2-1-3-7-13)11-12-10-18-14-8-4-5-9-15(14)19-12/h1-10H,11H2
InChIKey WPBSVXPYDMOVTM-UHFFFAOYSA-N
Molecular Weight 320.439 g/mol
SMILES C(S(=O)(=O)c1ccccc1)C=1Sc2ccccc2SC1
SPLASH splash10-004i-3900000000-641f682e75b2b351d035
Source of Spectrum J-57-1167-18
Synonyms 1,4-benzodithiin-2-ylmethyl phenyl sulfone
Wiley ID 1319819