| SpectraBase Spectrum ID |
4lsgNCTczg |
| Name |
Acetylsalicylic acid-M 2ME @ |
| CAS Registry Number |
27796-49-2 |
| Classification |
Analgesic
Dermatic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
223.084457899 u |
| Formula |
C11H13NO4 |
| InChI |
InChI=1S/C11H13NO4/c1-15-9-6-4-3-5-8(9)11(14)12-7-10(13)16-2/h3-6H,7H2,1-2H3,(H,12,14) |
| InChIKey |
DMFZPUCQOXSNME-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
223.228 g/mol |
| SMILES |
c1c(C(NCC(OC)=O)=O)c(ccc1)OC |
| SPLASH |
splash10-000l-7900000000-9ff18d3fc2c2fd51a0e7 |
| 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: UME |
| 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 2ME |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_958 |
