α-Hydroxyhippuric acid

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Systematic / IUPAC Name: 2-Benzamido-2-hydroxyacetic acid

ID: Reference321

Other Names: α-Hydroxyhippuric acid;
2-(Benzoylamino)-2-hydroxyacetic acid;
α-Hydroxybenzoylglycine;
(Benzoylamino)hydroxyacetic acid;
2-Hydroxy-2-(phenylcarbonylamino)acetic acid

Formula: C9H9NO4

Class: Endogenous Metabolites

Spectral Data

α-Hydroxyhippuric acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 182
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 12/15/2014 1:44:32 PM
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Identificators

InChI InChI=1S/C9H9NO4/c11-7(10-8(12)9(13)14)6-4-2-1-3-5-6/h1-5,8,12H,(H,10,11)(H,13,14)
InChI Key GCWCVCCEIQXUQU-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)C(=O)NC(C(=O)O)O
CAS 16555774
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Other Names α-Hydroxyhippuric acid;
2-(Benzoylamino)-2-hydroxyacetic acid;
α-Hydroxybenzoylglycine;
(Benzoylamino)hydroxyacetic acid;
2-Hydroxy-2-(phenylcarbonylamino)acetic acid;
Acetic acid, (benzoylamino)hydroxy-

In Other Databases

ChemSpider 396607
ChEBI CHEBI:68451
HMDb HMDB02404
PubChem 450272