| SpectraBase Compound ID | 3AAfTF5CCie |
|---|---|
| InChI | InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)/p-1 |
| InChIKey | QIAFMBKCNZACKA-UHFFFAOYSA-M |
| Mol Weight | 178.17 g/mol |
| Molecular Formula | C9H8NO3 |
| Exact Mass | 178.050418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kj5fTvB7AlQ |
|---|---|
| Name | Hippurate anion |
| Comments | sodium salt |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H8NO3 |
| InChI | InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)/p-1 |
| InChIKey | QIAFMBKCNZACKA-UHFFFAOYSA-M |
| Instrument Name | Varian HA-100 |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |