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4-Phenylmandelic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-Phenylmandelic acid
SpectraBase Compound ID HQZgcebHKHW
InChI InChI=1S/C14H12O3/c15-13(14(16)17)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13,15H,(H,16,17)
InChIKey JLZDBGVLWCMKMH-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C14H12O3
Exact Mass 228.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jfwgz1SKUpj
Name 4-Phenylmandelic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O3
InChI InChI=1S/C14H12O3/c15-13(14(16)17)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13,15H,(H,16,17)
InChIKey JLZDBGVLWCMKMH-UHFFFAOYSA-N
Molecular Weight 228.247 g/mol
SMILES OC(C(c1ccc(cc1)-c1ccccc1)O)=O
SPLASH splash10-003r-0930000000-987af9ba0cbf54648845
Source of Spectrum H-87-2888-0
Synonyms 2-Hydroxy-2-(4-phenylphenyl)acetic acid 2-Oxidanyl-2-(4-phenylphenyl)ethanoic acid
Wiley ID 1564147