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Cinnamyl 4,4-Dicyano-3-phenylbutyrate
SpectraBase Compound ID JDLmtABAUjh
InChI InChI=1S/C21H18N2O2/c22-15-19(16-23)20(18-11-5-2-6-12-18)14-21(24)25-13-7-10-17-8-3-1-4-9-17/h1-12,19-20H,13-14H2/b10-7+
InChIKey QBBBIFVLOILBDJ-JXMROGBWSA-N
Mol Weight 330.39 g/mol
Molecular Formula C21H18N2O2
Exact Mass 330.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5blrkdV8FMn
Name Cinnamyl 4,4-Dicyano-3-phenylbutyrate
Alternate Name(s) (2E)-3-phenyl-2-propenyl 4,4-dicyano-3-phenylbutanoate 4,4-Dicyano-3-phenyl-butyric acid[(E)-cinnamyl]ester 4,4-Dicyano-3-phenylbutanoic acid[(E)-3-phenylprop-2-enyl]ester [(E)-3-phenylprop-2-enyl]4,4-dicyano-3-phenyl-butanoate [(E)-cinnamyl]4,4-dicyano-3-phenyl-butanoate 4,4-Dicyano-3-phenylbutanoic acid [(E)-3-phenylprop-2-enyl] ester [(E)-3-phenylprop-2-enyl] 4,4-dicyano-3-phenylbutanoate [(E)-cinnamyl] 4,4-dicyano-3-phenyl-butanoate [(E)-3-phenylprop-2-enyl] 4,4-dicyano-3-phenyl-butanoate
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Formula C21H18N2O2
InChI InChI=1S/C21H18N2O2/c22-15-19(16-23)20(18-11-5-2-6-12-18)14-21(24)25-13-7-10-17-8-3-1-4-9-17/h1-12,19-20H,13-14H2/b10-7+
InChIKey QBBBIFVLOILBDJ-JXMROGBWSA-N
Molecular Weight 330.387 g/mol
SMILES C(#N)C(C(CC(=O)OC\C=C\c1ccccc1)c1ccccc1)C#N
SPLASH splash10-0159-0901000000-db0aecab55428b811297
Source of Spectrum F-53-2905-3
Wiley ID 800858