| SpectraBase Spectrum ID |
LXRX46dkfJ6 |
| Name |
Acetylsalicylic acid-M @ |
| CAS Registry Number |
487-54-7 |
| Classification |
Analgesic
Dermatic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
195.053157770 u |
| Formula |
C9H9NO4 |
| InChI |
InChI=1S/C9H9NO4/c11-7-4-2-1-3-6(7)9(14)10-5-8(12)13/h1-4,11H,5H2,(H,10,14)(H,12,13) |
| InChIKey |
ONJSZLXSECQROL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
195.174 g/mol |
| SMILES |
c1(O)c(C(NCC(O)=O)=O)cccc1 |
| SPLASH |
splash10-00di-6900000000-297c5e860992ea6324d4 |
| 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 |
Salicylic acid glycine conjugate |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_956 |
