For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,4-Naphthalenedione, 2-(2-oxopropyl)-3-(phenylthio)-
SpectraBase Compound ID DOzzGBoIn5n
InChI InChI=1S/C19H14O3S/c1-12(20)11-16-17(21)14-9-5-6-10-15(14)18(22)19(16)23-13-7-3-2-4-8-13/h2-10H,11H2,1H3
InChIKey HICRODCBUBJEDI-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C19H14O3S
Exact Mass 322.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2MbjRTC96vj
Name 1,4-Naphthalenedione, 2-(2-oxopropyl)-3-(phenylthio)-
CAS Registry Number 129155-19-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14O3S
InChI InChI=1S/C19H14O3S/c1-12(20)11-16-17(21)14-9-5-6-10-15(14)18(22)19(16)23-13-7-3-2-4-8-13/h2-10H,11H2,1H3
InChIKey HICRODCBUBJEDI-UHFFFAOYSA-N
Molecular Weight 322.378 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cccc2)Sc1ccccc1)CC(=O)C
SPLASH splash10-0089-0095000000-017fc4b435c72fdcff26
Source of Spectrum KC-1990-443-5
Synonyms 2-(2-oxopropyl)-3-(phenylsulfanyl)naphthoquinone 2-Acetonyl-3-phenylthio-1,4-naphthoquinone
Wiley ID 1321756