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Methyl 2-cyano-3,4-Dimethyl-4-phenylcrotonate
SpectraBase Compound ID KITRTRa9O89
InChI InChI=1S/C14H15NO2/c1-10(12-7-5-4-6-8-12)11(2)13(9-15)14(16)17-3/h4-8,10H,1-3H3/b13-11+
InChIKey JXVNWIXOSVWSTF-ACCUITESSA-N
Mol Weight 229.28 g/mol
Molecular Formula C14H15NO2
Exact Mass 229.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aTmSUgHb8X
Name Methyl 2-cyano-3,4-Dimethyl-4-phenylcrotonate
Alternate Name(s) Methyl (2E)-2-cyano-3-methyl-4-phenyl-2-pentenoate (E)-2-cyano-3-methyl-4-phenyl-2-pentenoic acid methyl ester Methyl (E)-2-cyano-3-methyl-4-phenylpent-2-enoate Methyl (E)-2-cyano-3-methyl-4-phenyl-pent-2-enoate
CAS Registry Number 64252-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO2
InChI InChI=1S/C14H15NO2/c1-10(12-7-5-4-6-8-12)11(2)13(9-15)14(16)17-3/h4-8,10H,1-3H3/b13-11+
InChIKey JXVNWIXOSVWSTF-ACCUITESSA-N
Molecular Weight 229.279 g/mol
SMILES C(\C(=C\(C(=O)OC)C#N)C)(c1ccccc1)C
SPLASH splash10-0002-0920000000-f202616cf4dc1e135e87
Source of Spectrum J-43-630-0
Wiley ID 1230804