| SpectraBase Compound ID | 3KpqxKPYbC8 |
|---|---|
| InChI | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9) |
| InChIKey | WPYMKLBDIGXBTP-UHFFFAOYSA-N |
| Mol Weight | 122.12 g/mol |
| Molecular Formula | C7H6O2 |
| Exact Mass | 122.036779 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KKZCeVaalAu |
|---|---|
| Name | BENZOIC ACID |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H6O2 |
| InChI | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9) |
| InChIKey | WPYMKLBDIGXBTP-UHFFFAOYSA-N |
| Molecular Weight | 122.0366 |
| SMILES | OC(=O)c1ccccc1 |
| SPLASH | splash10-0pk9-9800000000-c445b29f4bb91f0b807c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |