| SpectraBase Spectrum ID |
IgcTtAALulA |
| Name |
Benzoic acid methylester @ |
| CAS Registry Number |
93-58-3 |
| Classification |
Perfume
Antilipemic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
136.052429496 u |
| Formula |
C8H8O2 |
| InChI |
InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey |
QPJVMBTYPHYUOC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
136.150 g/mol |
| SMILES |
c1c(cccc1)C(OC)=O |
| SPLASH |
splash10-0a6u-9600000000-6fcf908a593e2c79198e |
| 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: P(ME) |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Benfluorex-M/artifact (benzoic acid) ME
Cocaine-M/artifact (benzoic acid) ME
Zofenopril artifact (benzoic acid) ME |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1211 |
