| SpectraBase Compound ID | 6jYimfHplMy |
|---|---|
| InChI | InChI=1S/C9H9NO3.Na.O/c11-8(12)6-10-9(13)7-4-2-1-3-5-7;;/h1-5H,6H2,(H,10,13)(H,11,12);;/q;+1;/p-1 |
| InChIKey | GEWMHXKKRFDZIZ-UHFFFAOYSA-M |
| Mol Weight | 217.15576928 g/mol |
| Molecular Formula | C9H8NNaO4 |
| Exact Mass | 217.035102 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 5zrxShrY1yL |
|---|---|
| Name | Sodium hippurate hydrate |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 271640 |
| CAS Registry Number | 532-94-5 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8NNaO4 |
| InChI | InChI=1S/C9H9NO3.Na.O/c11-8(12)6-10-9(13)7-4-2-1-3-5-7;;/h1-5H,6H2,(H,10,13)(H,11,12);;/q;+1;/p-1 |
| InChIKey | GEWMHXKKRFDZIZ-UHFFFAOYSA-M |
| Observed nucleus | 1H |
| Purity | 99% |
| Solvent | DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | Hippuric acid sodium salt hydrate |
| Wiley ID | SIAL_1HNMR_004883 |