| SpectraBase Spectrum ID |
CC5gwMGBVfi |
| Name |
Benzoic acid glycine conjugate @ |
| CAS Registry Number |
495-69-2 |
| Classification |
Biomolecule
Antilipemic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
179.058243151 u |
| 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 |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
179.175 g/mol |
| SMILES |
c1ccc(C(NCC(O)=O)=O)cc1 |
| SPLASH |
splash10-0a4i-2900000000-c4a105c5e4f79b134a6f |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: U |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Benfluorex-M (hippuric acid)
Hippuric acid |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_96 |
