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PAPULINE
SpectraBase Compound ID LUgCtaZjJPx
InChI InChI=1S/C10H12O3/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3
InChIKey NMPPJJIBQQCOOI-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J05Viy1EJ6p
Name Benzenepropanoic acid, .alpha.-hydroxy-, methyl ester
CAS Registry Number 21632-25-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3
InChIKey NMPPJJIBQQCOOI-UHFFFAOYSA-N
Molecular Weight 180.203 g/mol
SMILES OC(C(=O)OC)Cc1ccccc1
SPLASH splash10-0006-9100000000-949609d8d61f5ba0a4c9
Source of Spectrum I-68-315-7
Synonyms .beta.-Phenyllactic acid methyl ester Methyl 2-hydroxy-3-phenylpropanoate Lactic acid, 3-phenyl-, methyl ester 2-Hydroxy-3-phenyl-propionic acid methyl ester 2-Hydroxy-3-phenylpropanoic acid methyl ester Methyl 2-hydroxy-3-phenyl-propanoate Methyl 2-hydroxy-3-phenylpropionate Methyl 2-oxidanyl-3-phenyl-propanoate
Wiley ID 1176253