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2,5-Cyclohexadiene-1,4-dione, 2-(phenylthio)-
SpectraBase Compound ID LL1Smo1fvy4
InChI InChI=1S/C12H8O2S/c13-9-6-7-11(14)12(8-9)15-10-4-2-1-3-5-10/h1-8H
InChIKey JRXZLRYQEYLRQH-UHFFFAOYSA-N
Mol Weight 216.25 g/mol
Molecular Formula C12H8O2S
Exact Mass 216.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGynV1o7nWy
Name 2,5-Cyclohexadiene-1,4-dione, 2-(phenylthio)-
CAS Registry Number 18232-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O2S
InChI InChI=1S/C12H8O2S/c13-9-6-7-11(14)12(8-9)15-10-4-2-1-3-5-10/h1-8H
InChIKey JRXZLRYQEYLRQH-UHFFFAOYSA-N
Molecular Weight 216.254 g/mol
SMILES C=1(Sc2ccccc2)C(=O)C=CC(C1)=O
SPLASH splash10-0fsr-9840000000-ee5ea62526fd66e17587
Source of Spectrum W5-17686-0-0
Synonyms 2-(Phenylsulfanyl)benzo-1,4-quinone 2-(Phenylthio)-p-benzoquinone 2-(Phenylthio)cyclohexa-2,5-diene-1,4-dione 2-Phenylsulfanyl-1,4-benzoquinone 2-Phenylsulfanylcyclohexa-2,5-diene-1,4-dione Phenylthiobenzoquinone
Wiley ID 1215430