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1,2-Naphthalenedione, 4-[(4-methylphenyl)thio]-
SpectraBase Compound ID HOmnFoE3rOI
InChI InChI=1S/C17H12O2S/c1-11-6-8-12(9-7-11)20-16-10-15(18)17(19)14-5-3-2-4-13(14)16/h2-10H,1H3
InChIKey WEFJPHYUHBUEFE-UHFFFAOYSA-N
Mol Weight 280.34 g/mol
Molecular Formula C17H12O2S
Exact Mass 280.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJB0ijjPQBp
Name 1,2-Naphthalenedione, 4-[(4-methylphenyl)thio]-
Alternate Name(s) 1,2-Naphthoquinone, 4-(p-tolylthio)- 4-(p-tolylthio)-1,2-naphthoquinone 4-[(4-methylphenyl)sulfanyl]-1,2-naphthalenedione
CAS Registry Number 19133-61-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O2S
InChI InChI=1S/C17H12O2S/c1-11-6-8-12(9-7-11)20-16-10-15(18)17(19)14-5-3-2-4-13(14)16/h2-10H,1H3
InChIKey WEFJPHYUHBUEFE-UHFFFAOYSA-N
Molecular Weight 280.341 g/mol
SMILES C1(=CC(=O)C(c2c1cccc2)=O)Sc1ccc(cc1)C
SPLASH splash10-0uk9-1290000000-c70b3daeae083edb87a1
Source of Spectrum KC-1986-2238-0
Wiley ID 1284059