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(E)-Methyl 4-(1-cyanoprop-1-en-2-yl)benzoate
SpectraBase Compound ID BQlPzNw74sn
InChI InChI=1S/C12H11NO2/c1-9(7-8-13)10-3-5-11(6-4-10)12(14)15-2/h3-7H,1-2H3/b9-7+
InChIKey MNIBVDFAQMYGDM-VQHVLOKHSA-N
Mol Weight 201.22 g/mol
Molecular Formula C12H11NO2
Exact Mass 201.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxlQUTlt4K4
Name (E)-Methyl 4-(1-cyanoprop-1-en-2-yl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO2
InChI InChI=1S/C12H11NO2/c1-9(7-8-13)10-3-5-11(6-4-10)12(14)15-2/h3-7H,1-2H3/b9-7+
InChIKey MNIBVDFAQMYGDM-VQHVLOKHSA-N
Literature Reference DOI 10.1002/anie.201402053
Molecular Weight 201.225 g/mol
SMILES c1cc(ccc1C(OC)=O)\C(=C\C#N)C
SPLASH splash10-00di-0920000000-25b6fa746c1927172871
Source of Spectrum ACI-53-SM21-3l
Synonyms Methyl (E)-4-(1-cyanoprop-1-en-2-yl)benzoate
Wiley ID 1782467