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1-(Cyanomethyl)-4-[2'-(methoxycarbonyl)ethyl]benzene
SpectraBase Compound ID D1GnsZqLKS9
InChI InChI=1S/C12H13NO2/c1-15-12(14)7-6-10-2-4-11(5-3-10)8-9-13/h2-5H,6-8H2,1H3
InChIKey KFXKHXXHQKKIDB-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6A9Y0XqurNl
Name 1-(Cyanomethyl)-4-[2'-(methoxycarbonyl)ethyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO2
InChI InChI=1S/C12H13NO2/c1-15-12(14)7-6-10-2-4-11(5-3-10)8-9-13/h2-5H,6-8H2,1H3
InChIKey KFXKHXXHQKKIDB-UHFFFAOYSA-N
Molecular Weight 203.241 g/mol
SMILES C(#N)Cc1ccc(cc1)CCC(=O)OC
SPLASH splash10-0frx-0900000000-e557e9bca4a1d36be3f1
Source of Spectrum U1-2009-229-16
Synonyms 3-(4-Cyanomethyl-phenyl)-propionic acid methyl ester 3-[4-(cyanomethyl)phenyl]propanoic acid methyl ester Methyl 3-[4-(cyanomethyl)phenyl]propanoate
Wiley ID 1662411