Hippuric acid
439
Reference
Hippuric acid Structure
Systematic / IUPAC Name: N-Benzoylglycine
ID: Reference439
Other Names:
Glycine, N-benzoyl-;
2-Benzamidoacetic acid;
Benzamidoacetic acid;
Phenylcarbonylaminoacetic acid;
(Benzoylamino)acetic acid
; more
Formula: C9H9NO3
Class: Endogenous Metabolites
Spectral Data
Hippuric acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Elite; Q Exactive Orbitrap; Q Exactive Plus Orbitrap |
| No. of Spectral Trees | 4 |
| No. of Spectra | 273 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 2/4/2015 10:19:39 AM |
Identificators
| 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) |
| InChI Key | QIAFMBKCNZACKA-UHFFFAOYSA-N |
| Canonical SMILES | C1=CC=C(C=C1)C(=O)NCC(=O)O |
| CAS | 495692 |
| Splash | |
| Other Names |
Glycine, N-benzoyl-; 2-Benzamidoacetic acid; Benzamidoacetic acid; Phenylcarbonylaminoacetic acid; (Benzoylamino)acetic acid; Acetic acid, (benzoylamino)-; 2-(Phenylformamido)acetic acid; N-(Phenylcarbonyl)glycine; 2-(Phenylcarbonylamino)acetic acid; Phenylcarbonylaminoacetate; Hippurate; Benzamidoacetate |