| SpectraBase Spectrum ID |
JGRkRk15lPU |
| Name |
Acetylsalicylic acid @ |
| CAS Registry Number |
50-78-2 |
| Classification |
Analgesic
Dermatic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
180.042258734 u |
| Formula |
C9H8O4 |
| InChI |
InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12) |
| InChIKey |
BSYNRYMUTXBXSQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
180.159 g/mol |
| SMILES |
c1cccc(OC(=O)C)c1C(O)=O |
| SPLASH |
splash10-00dr-5900000000-8ff37ce8674dea0f491b |
| 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: G P-I U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Salicylic acid AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1443 |
