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(E)-Ethyl 4-(4-cyanostyryl)benzoate
SpectraBase Compound ID CmF8J6iR4Zc
InChI InChI=1S/C18H15NO2/c1-2-21-18(20)17-11-9-15(10-12-17)4-3-14-5-7-16(13-19)8-6-14/h3-12H,2H2,1H3/b4-3+
InChIKey CHJYYPPUEAVUME-ONEGZZNKSA-N
Mol Weight 277.32 g/mol
Molecular Formula C18H15NO2
Exact Mass 277.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWJsRUcjSXU
Name (E)-Ethyl 4-(4-cyanostyryl)benzoate
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO2
InChI InChI=1S/C18H15NO2/c1-2-21-18(20)17-11-9-15(10-12-17)4-3-14-5-7-16(13-19)8-6-14/h3-12H,2H2,1H3/b4-3+
InChIKey CHJYYPPUEAVUME-ONEGZZNKSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500943
Quality 6
Reported Formula C18H15NO2
SMILES C(C)OC(C1=CC=C(C=C1)\C=C\C1=CC=C(C=C1)C#N)=O
SPLASH splash10-0fc0-0090000000-23169a092e6d132d505e
Sample Comments Z/E = 5:95
Source of Spectrum QE-21-SM8-E-4j (DOI: 10.1002/chem.201500943)
Wiley ID 1906463