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Benzoic acid, [1-cyano-1-(5-oxotetrahydrofuran-2-yl)-3-phenyl]propyl ester

View entire compound with spectra: 2 MS (GC)

Benzoic acid, [1-cyano-1-(5-oxotetrahydrofuran-2-yl)-3-phenyl]propyl ester
SpectraBase Compound ID 93PHkGwPXIW
InChI InChI=1S/C21H19NO4/c22-15-21(18-11-12-19(23)25-18,14-13-16-7-3-1-4-8-16)26-20(24)17-9-5-2-6-10-17/h1-10,18H,11-14H2
InChIKey ANPMWQJSMZKUFF-UHFFFAOYSA-N
Mol Weight 349.39 g/mol
Molecular Formula C21H19NO4
Exact Mass 349.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kni7KN3jxUc
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H19NO4
InChI InChI=1S/C21H19NO4/c22-15-21(18-11-12-19(23)25-18,14-13-16-7-3-1-4-8-16)26-20(24)17-9-5-2-6-10-17/h1-10,18H,11-14H2
InChIKey ANPMWQJSMZKUFF-UHFFFAOYSA-N
Molecular Weight 349.1309
SMILES C1(C(OC(c2ccccc2)=O)(C#N)CCc2ccccc2)OC(=O)CC1
SPLASH splash10-053l-7910000000-5f854a91f81c2a8e347a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany