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Ethyl (2E)-2-cyano-3-(methylamino)-3-(methylsulfanyl)-2-propenoate
SpectraBase Compound ID FPZ0MgOx8Eo
InChI InChI=1S/C8H12N2O2S/c1-4-12-8(11)6(5-9)7(10-2)13-3/h10H,4H2,1-3H3/b7-6+
InChIKey RXXVKSHDQQDVFX-VOTSOKGWSA-N
Mol Weight 200.26 g/mol
Molecular Formula C8H12N2O2S
Exact Mass 200.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54Sr3Ro71nD
Name Ethyl (2E)-2-cyano-3-(methylamino)-3-(methylsulfanyl)-2-propenoate
CAS Registry Number 129392-58-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12N2O2S
InChI InChI=1S/C8H12N2O2S/c1-4-12-8(11)6(5-9)7(10-2)13-3/h10H,4H2,1-3H3/b7-6+
InChIKey RXXVKSHDQQDVFX-VOTSOKGWSA-N
Molecular Weight 200.256 g/mol
SMILES N(\C(=C/(C(=O)OCC)C#N)SC)C
SPLASH splash10-0059-9500000000-b654a7862900b9f4858d
Source of Spectrum AD-0-2532-0
Synonyms (E)-2-cyano-3-(methylamino)-3-(methylthio)-2-propenoic acid ethyl ester (E)-2-cyano-3-(methylamino)-3-(methylthio)acrylic acid ethyl ester Ethyl (E)-2-cyano-3-(methylamino)-3-methylsulfanyl-prop-2-enoate Propenoic acid, 2-cyano-3-methylamino-3-methylthio-, ethyl ester
Wiley ID 1428338