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phenylacetic acid, phenyl ester

View entire compound with spectra: 2 NMR, 2 FTIR, and 4 MS (GC)

phenylacetic acid, phenyl ester
SpectraBase Compound ID 3dAtMIfciFJ
InChI InChI=1S/C13H18O2/c1-2-3-7-10-15-13(14)11-12-8-5-4-6-9-12/h4-6,8-9H,2-3,7,10-11H2,1H3
InChIKey LRVLBFSVAFUOGO-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kahJ0ibMO
Name Pentyl phenylacetate
Alternate Name(s) Amyl phenylacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-2-3-7-10-15-13(14)11-12-8-5-4-6-9-12/h4-6,8-9H,2-3,7,10-11H2,1H3
InChIKey LRVLBFSVAFUOGO-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 206.285 g/mol
SMILES CCCCCOC(=O)Cc1ccccc1
SPLASH splash10-0006-9100000000-5f3b3577456cd86a4fc5
Source of Spectrum SRH-2022-8503-0
Wiley ID 1830199