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(5E)-3-benzoyl-5-(4-methylbenzylidene)-2-thioxo-thiazolidin-4-one

View entire compound with spectra: 2 MS (GC)

(5E)-3-benzoyl-5-(4-methylbenzylidene)-2-thioxo-thiazolidin-4-one
SpectraBase Compound ID 4mvpf8vSN9h
InChI InChI=1S/C18H13NO2S2/c1-12-7-9-13(10-8-12)11-15-17(21)19(18(22)23-15)16(20)14-5-3-2-4-6-14/h2-11H,1H3/b15-11+
InChIKey ANVDJVHITRMCAJ-RVDMUPIBSA-N
Mol Weight 339.43 g/mol
Molecular Formula C18H13NO2S2
Exact Mass 339.038771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TEnZC1qTEH
Name 3-(BENENCARBOXYL),5-(4'-METHYLBENZILIDENE)THIAZOLIDINE-4-ON-2-THIONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H13NO2S2
InChI InChI=1S/C18H13NO2S2/c1-12-7-9-13(10-8-12)11-15-17(21)19(18(22)23-15)16(20)14-5-3-2-4-6-14/h2-11H,1H3/b15-11+
InChIKey ANVDJVHITRMCAJ-RVDMUPIBSA-N
Molecular Weight 339.0385
SMILES c1(\C=C\2SC(=S)N(C(c3ccccc3)=O)C2=O)ccc(C)cc1
SPLASH splash10-0a4i-5900000000-7dba17a1aa1c35cf34bf
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany