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Benzoic acid 1-(4-cyano-phenyl)-but-3-enyl ester
SpectraBase Compound ID 233MkZCTmPE
InChI InChI=1S/C18H15NO2/c1-2-6-17(15-11-9-14(13-19)10-12-15)21-18(20)16-7-4-3-5-8-16/h2-5,7-12,17H,1,6H2
InChIKey OQNBTGPWBOYQCX-UHFFFAOYSA-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 HIwk4vWhEjy
Name Benzoic acid 1-(4-cyano-phenyl)-but-3-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO2
InChI InChI=1S/C18H15NO2/c1-2-6-17(15-11-9-14(13-19)10-12-15)21-18(20)16-7-4-3-5-8-16/h2-5,7-12,17H,1,6H2
InChIKey OQNBTGPWBOYQCX-UHFFFAOYSA-N
Molecular Weight 277.323 g/mol
SMILES C(OC(c1ccc(C#N)cc1)CC=C)(=O)c1ccccc1
SPLASH splash10-0a4i-2900000000-512db5bc27dbc87741cb
Source of Spectrum QC-21-3003-18a
Wiley ID 1688174