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2-Pentenenitrile, 2-(acetyloxy)-5-phenyl-3-(2-phenylethyl)-
SpectraBase Compound ID CDDM8pGv8Zx
InChI InChI=1S/C21H21NO2/c1-17(23)24-21(16-22)20(14-12-18-8-4-2-5-9-18)15-13-19-10-6-3-7-11-19/h2-11H,12-15H2,1H3
InChIKey NOEJREOWKNNGQS-UHFFFAOYSA-N
Mol Weight 319.4 g/mol
Molecular Formula C21H21NO2
Exact Mass 319.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DyQhvj7cnRV
Name 2-Pentenenitrile, 2-(acetyloxy)-5-phenyl-3-(2-phenylethyl)-
CAS Registry Number 62115-07-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO2
InChI InChI=1S/C21H21NO2/c1-17(23)24-21(16-22)20(14-12-18-8-4-2-5-9-18)15-13-19-10-6-3-7-11-19/h2-11H,12-15H2,1H3
InChIKey NOEJREOWKNNGQS-UHFFFAOYSA-N
Molecular Weight 319.404 g/mol
SMILES C(=C(CCc1ccccc1)CCc1ccccc1)(C#N)OC(=O)C
SPLASH splash10-0006-9200000000-044d357260cfd1c37ec7
Source of Spectrum C-99-184-0
Synonyms Acetic acid [1-cyano-4-phenyl-2-(2-phenylethyl)but-1-enyl] ester [1-cyano-4-phenyl-2-(2-phenylethyl)but-1-enyl] acetate [1-cyano-4-phenyl-2-(2-phenylethyl)but-1-enyl] ethanoate
Wiley ID 1319518