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3-Allyl-5-benzylidene-4-oxothiazolidine-2-thione - S-oxide
SpectraBase Compound ID EW4RCefnj66
InChI InChI=1S/C13H11NO2S2/c1-2-8-14-12(15)11(18(16)13(14)17)9-10-6-4-3-5-7-10/h2-7,9H,1,8H2/b11-9-
InChIKey CDQCMUANMUANGJ-LUAWRHEFSA-N
Mol Weight 277.36 g/mol
Molecular Formula C13H11NO2S2
Exact Mass 277.023121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L80KM0duIdv
Name 3-Allyl-5-benzylidene-4-oxothiazolidine-2-thione - S-oxide
CAS Registry Number 138696-26-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO2S2
InChI InChI=1S/C13H11NO2S2/c1-2-8-14-12(15)11(18(16)13(14)17)9-10-6-4-3-5-7-10/h2-7,9H,1,8H2/b11-9-
InChIKey CDQCMUANMUANGJ-LUAWRHEFSA-N
Molecular Weight 277.356 g/mol
SMILES C1(S(\C(C(N1CC=C)=O)=C\c1ccccc1)=O)=S
SPLASH splash10-001i-0940000000-5da963ecc1be4600c117
Source of Spectrum U-1992-341-5
Synonyms (5Z)-3-allyl-5-benzylidene-2-thioxo-1,3-thiazolidin-4-one 1-oxide
Wiley ID 764005