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Ethyl 3-[( 5'-phenyl-[1,2]-dithiol-3'-ylidene)thiocarbamoyl]-propanoate
SpectraBase Compound ID 2Y2pA8mT2uw
InChI InChI=1S/C15H15NO2S3/c1-2-18-15(17)9-8-13(19)16-14-10-12(20-21-14)11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3/b16-14-
InChIKey NKRFEAUAGNMPHZ-PEZBUJJGSA-N
Mol Weight 337.47 g/mol
Molecular Formula C15H15NO2S3
Exact Mass 337.026492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDK98HvCO5v
Name Ethyl 3-[( 5'-phenyl-[1,2]-dithiol-3'-ylidene)thiocarbamoyl]-propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO2S3
InChI InChI=1S/C15H15NO2S3/c1-2-18-15(17)9-8-13(19)16-14-10-12(20-21-14)11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3/b16-14-
InChIKey NKRFEAUAGNMPHZ-PEZBUJJGSA-N
Molecular Weight 337.470 g/mol
SMILES C=1\C(=N\C(=S)CCC(=O)OCC)SSC1c1ccccc1
SPLASH splash10-0fri-5967000000-90e29b5702b6635c8f36
Source of Spectrum QA-69-916-6
Synonyms Ethyl 4-{[(3Z)-5-phenyl-3H-1,2-dithiol-3-ylidene]amino}-4-thioxobutanoate
Wiley ID 1576254