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Benzoic acid phenethyl ester
SpectraBase Compound ID K0MzJpYrQnx
InChI InChI=1S/C15H14O2/c16-15(14-9-5-2-6-10-14)17-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKey OSORMYZMWHVFOZ-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C15H14O2
Exact Mass 226.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3wfyR8N9iB
Name Benzoic acid, 2-phenylethyl ester
CAS Registry Number 94-47-3
Classification Benzoic acid esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 226.099379689 u
Formula C15H14O2
InChI InChI=1S/C15H14O2/c16-15(14-9-5-2-6-10-14)17-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKey OSORMYZMWHVFOZ-UHFFFAOYSA-N
Molecular Weight 226.275 g/mol
Number of Peaks 4
SMILES C(c1ccccc1)(=O)OCCc1ccccc1
SPLASH splash10-0udi-3900000000-f6e541045d0f1b088581
Source of Spectrum FF-22-355-355_15 (DOI: 10.1002/ffj.1804)
Synonyms .beta.-Phenethyl benzoate .beta.-Phenylethyl benzoate 2-Fenylethylester kyseliny benzoove 2-Phenylethyl benzoate Phenethyl benzoate Benzoic acid phenethyl ester Benzyl carbinyl benzoate Phenethyl alcohol, benzoate Benzoic acid, phenethyl ester Phenylethyl benzoate Benzylcarbinyl benzoate Benzoic acid 2-phenylethyl ester AI3-01813 BRN 2052132 EINECS 202-336-5 FEMA NO. 2860 NSC 24096
Wiley ID 1775479