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(E)-3-(4-Cyanophenyl)allyl acetate
SpectraBase Compound ID Er7YSNUPfCJ
InChI InChI=1S/C12H11NO2/c1-10(14)15-8-2-3-11-4-6-12(9-13)7-5-11/h2-7H,8H2,1H3/b3-2+
InChIKey YSJLZWPTVPORTG-NSCUHMNNSA-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 Gq8NJSJHWH2
Name (E)-3-(4-Cyanophenyl)allyl acetate
Alternate Name(s) Acetic acid [(E)-3-(4-cyanophenyl)prop-2-enyl] ester [(E)-3-(4-cyanophenyl)prop-2-enyl] acetate [(E)-3-(4-cyanophenyl)allyl] acetate [(E)-3-(4-cyanophenyl)prop-2-enyl] ethanoate
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Formula C12H11NO2
InChI InChI=1S/C12H11NO2/c1-10(14)15-8-2-3-11-4-6-12(9-13)7-5-11/h2-7H,8H2,1H3/b3-2+
InChIKey YSJLZWPTVPORTG-NSCUHMNNSA-N
Literature Reference DOI 10.1002/adsc.201100889
Molecular Weight 201.225 g/mol
SMILES C(OC(C)=O)\C=C\c1ccc(cc1)C#N
SPLASH splash10-0a5c-0910000000-3f72effc913e2807ddc6
Source of Spectrum ASC-354-1075-22
Wiley ID 1763021