| SpectraBase Compound ID | 7AZ8DZAeGid |
|---|---|
| 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 |
| Mol Weight | 180.16 g/mol |
| Molecular Formula | C9H8O4 |
| Exact Mass | 180.042259 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BRRkT9stqCr |
|---|---|
| Name | Aspirin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| 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 |
| Molecular Weight | 180.159 g/mol |
| SMILES | OC(=O)c1ccccc1OC(C)=O |
| SPLASH | splash10-00dl-7900000000-130696571305b1784f14 |
| Source of Spectrum | SWG-33-1621-0 |
| Synonyms | Acetylsalicylic acid ASA 2-Acetoxybenzoic acid |
| Wiley ID | 1809281 |