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Hippuric acid methyl ester
SpectraBase Compound ID 2vFaUfGmF0X
InChI InChI=1S/C10H11NO3/c1-14-9(12)7-11-10(13)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,13)
InChIKey XTKVNQKOTKPCKM-UHFFFAOYSA-N
Mol Weight 193.2 g/mol
Molecular Formula C10H11NO3
Exact Mass 193.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2n268oTTpdQ
Name Hippuric acid methyl ester
CAS Registry Number 1205-08-9
Classification Pharmaceutical drug, antilipemic
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 193.073893215 u
Formula C10H11NO3
InChI InChI=1S/C10H11NO3/c1-14-9(12)7-11-10(13)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,13)
InChIKey XTKVNQKOTKPCKM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 193.202 g/mol
Nominal Mass 193 u
Quality 862
Retention Index 1497
SMILES C(C=1C=CC=CC1)(NCC(OC)=O)=O
SPLASH splash10-0a4i-2900000000-444312babdfac040671e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benzoic acid-glycine conjugate ME Methyl benzamidoacetate
Technique GC/MS
Wiley ID DD2024_005288