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2-Butenoic acid, 2-cyano-3-phenyl-, ethyl ester

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 MS (GC)

2-Butenoic acid, 2-cyano-3-phenyl-, ethyl ester
SpectraBase Compound ID AWOFFcU3GdT
InChI InChI=1S/C13H13NO2/c1-3-16-13(15)12(9-14)10(2)11-7-5-4-6-8-11/h4-8H,3H2,1-2H3/b12-10+
InChIKey AJDOTEWSLNGINB-ZRDIBKRKSA-N
Mol Weight 215.25 g/mol
Molecular Formula C13H13NO2
Exact Mass 215.094629 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 7x1y06AhJoq
Name Ethyl 2-cyano-3-phenyl-2-butenoate, mixture of cis and trans
Source of Sample Aldrich
Catalog Number 398756
CAS Registry Number 18300-89-5
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO2
InChI InChI=1S/C13H13NO2/c1-3-16-13(15)12(9-14)10(2)11-7-5-4-6-8-11/h4-8H,3H2,1-2H3/b12-10+
InChIKey AJDOTEWSLNGINB-ZRDIBKRKSA-N
Purity 98%
Synonyms 2-Butenoic acid,2-cyano-3-phenyl-, ethyl ester
Wiley ID SIAL_ATR-IR_018494