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2-(Phenylthio)-5-(2-acetylanilino)-1,4-benzoquinone
SpectraBase Compound ID 3j70uizfLOY
InChI InChI=1S/C20H15NO3S/c1-13(22)15-9-5-6-10-16(15)21-17-11-19(24)20(12-18(17)23)25-14-7-3-2-4-8-14/h2-12,21H,1H3
InChIKey RWTGVAGKHYAQFZ-UHFFFAOYSA-N
Mol Weight 349.4 g/mol
Molecular Formula C20H15NO3S
Exact Mass 349.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2edPcRYcvWs
Name 2-(Phenylthio)-5-(2-acetylanilino)-1,4-benzoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15NO3S
InChI InChI=1S/C20H15NO3S/c1-13(22)15-9-5-6-10-16(15)21-17-11-19(24)20(12-18(17)23)25-14-7-3-2-4-8-14/h2-12,21H,1H3
InChIKey RWTGVAGKHYAQFZ-UHFFFAOYSA-N
Molecular Weight 349.404 g/mol
SMILES N(C1=CC(C(Sc2ccccc2)=CC1=O)=O)c1c(C(=O)C)cccc1
SPLASH splash10-0a5i-0309000000-70d6f4dc3dfb7590a2dd
Source of Spectrum F-66-4978-13b
Wiley ID 1683251