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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

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DOvE7ewFMWB
Name Hippuric acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 112003
CAS Registry Number 495-69-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 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
Observed nucleus 13C
Purity 98%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms N-Benzoylglycine Benzoylaminoacetic acid
Wiley ID SIAL_13CNMR_000346