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Hippuric acid

View entire compound with spectra: 10 NMR, 5 FTIR, 1 Raman, 1 UV-Vis, and 17 MS (GC)

Hippuric acid
SpectraBase Compound ID 3AAgPJa6QAC
InChI InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)
InChIKey QIAFMBKCNZACKA-UHFFFAOYSA-N
Mol Weight 179.17 g/mol
Molecular Formula C9H9NO3
Exact Mass 179.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkZLZDNXtoy
Name Glycine, N-benzoyl-
Alternate Name(s) N-Benzoyl-.alpha.-amidoethanoic acid (benzoylamino)acetic acid 2-Benzamidoacetic acid 2-Benzamidoethanoic acid Acetic acid, (benzoylamino)- Acido ippurico Benzamidoacetic acid Benzamidoessigsaeure Benzenecarboxamide, N-carboxymethyl- Benzoylaminoessigsaeure Benzoylglycin Benzoylglycine Benzoylglycocoll Hippurate Hippuric acid Hippursaeure N-Benzoyl-glycin N-Benzoylglycine Phenylcarbonylaminoacetic acid AI3-01062 BRN 1073987 EINECS 207-806-3 NSC 9982
CAS Registry Number 495-69-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO3
InChI InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)
InChIKey QIAFMBKCNZACKA-UHFFFAOYSA-N
Molecular Weight 179.175 g/mol
SMILES N(CC(=O)O)C(=O)c1ccccc1
SPLASH splash10-0kdi-9600000000-43bbf46ebe8859b689a5
Source of Spectrum EP-4613-0-0
Wiley ID 1175092