| SpectraBase Compound ID | 3KpqdyFFrNc |
|---|---|
| InChI | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/p-1 |
| InChIKey | WPYMKLBDIGXBTP-UHFFFAOYSA-M |
| Mol Weight | 121.11 g/mol |
| Molecular Formula | C7H5O2 |
| Exact Mass | 121.028954 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8SU6TbjOq8P |
|---|---|
| Name | Benzoate anion |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H5O2 |
| InChI | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/p-1 |
| InChIKey | WPYMKLBDIGXBTP-UHFFFAOYSA-M |
| Instrument Name | Bruker HX-270 |
| Literature Reference | L.M. Schwartz, G.I. Gelb, D.A.Laufer, J. Chem. Soc. Perkin II 1987, 453. |
| NMR Standard | TMS Ext. |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |