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2-cyano-2-(1-phenylpropyl)-4-pentenoic acid ethyl ester
SpectraBase Compound ID DZ3P6CHgakj
InChI InChI=1S/C17H21NO2/c1-4-12-17(13-18,16(19)20-6-3)15(5-2)14-10-8-7-9-11-14/h4,7-11,15H,1,5-6,12H2,2-3H3
InChIKey QDNLKTOFTFIWEE-UHFFFAOYSA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxQgXAz88lD
Name 2-cyano-2-(1-phenylpropyl)-4-pentenoic acid ethyl ester
Alternate Name(s) 2-cyano-2-(1-phenylpropyl)pent-4-enoic acid ethyl ester Ethyl 2-cyano-2-(1-phenylpropyl)pent-4-enoate
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Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-4-12-17(13-18,16(19)20-6-3)15(5-2)14-10-8-7-9-11-14/h4,7-11,15H,1,5-6,12H2,2-3H3
InChIKey QDNLKTOFTFIWEE-UHFFFAOYSA-N
Molecular Weight 271.360 g/mol
SMILES C(C(CC=C)(C(CC)c1ccccc1)C#N)(=O)OCC
SPLASH splash10-014l-6900000000-01b3edfd14d72efb9b7c
Source of Spectrum U1-1999-2334-3
Wiley ID 753762