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PARA-METHYL-ETHYL-(E)-(ALPHA-CYANO)-CINNAMATE
SpectraBase Compound ID 2XTrXTnoIs4
InChI InChI=1S/C13H13NO2/c1-3-16-13(15)12(9-14)8-11-6-4-10(2)5-7-11/h4-8H,3H2,1-2H3/b12-8+
InChIKey KKIZDEFOEGGSKX-XYOKQWHBSA-N
Mol Weight 215.25 g/mol
Molecular Formula C13H13NO2
Exact Mass 215.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PD6AFh8Dtj
Name Ethyl (2E)-2-cyano-3-(4-methylphenyl)-2-propenoate
Alternate Name(s) (E)-2-cyano-3-(4-methylphenyl)-2-propenoic acid ethyl ester (E)-2-cyano-3-(p-tolyl)acrylic acid ethyl ester 2-Propenoic acid, 2-cyano-3-(4-methylphenyl)-, ethyl ester Ethyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate Ethyl (E)-2-cyano-3-(p-tolyl)prop-2-enoate
CAS Registry Number 18300-87-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO2
InChI InChI=1S/C13H13NO2/c1-3-16-13(15)12(9-14)8-11-6-4-10(2)5-7-11/h4-8H,3H2,1-2H3/b12-8+
InChIKey KKIZDEFOEGGSKX-XYOKQWHBSA-N
Molecular Weight 215.252 g/mol
SMILES C(\C(=C\c1ccc(cc1)C)C#N)(=O)OCC
SPLASH splash10-014i-1940000000-619ce385eeb39db15dd9
Source of Spectrum K1-2004-550-3
Wiley ID 1560276