| 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 |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2mrCEzecV6B |
|---|---|
| Name | BENZOIC_ACID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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 |
| Literature Reference Author | H.DAHN,P.PECHY,V.V.TOAN |
| Literature Reference Citation | ANGEW.CHEM.,102,681(1990) |
| Literature Reference DOI | 10.1002/ange.19901020613 |
| Solvent | CH3CN |
| Source File Reference | UHPK1166 |