| SpectraBase Compound ID | ARZ0oXUCYNv |
|---|---|
| InChI | InChI=1S/C9H9NO4.Ca.4H2O/c1-5(11)10-6-2-3-7(9(13)14)8(12)4-6;;;;;/h2-4,12H,1H3,(H,10,11)(H,13,14);;4*1H2/q;+2;;;;/p-2 |
| InChIKey | KNWZMFPMRVWYPH-UHFFFAOYSA-L |
| Mol Weight | 305.3 g/mol |
| Molecular Formula | C9H15CaNO8 |
| Exact Mass | 305.042357 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4zdmLfSR0Ze |
|---|---|
| Name | 4-acetamidosalicylic acid, calcium hydroxide salt, trihydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H15CaNO8 |
| InChI | InChI=1S/C9H9NO4.Ca.4H2O/c1-5(11)10-6-2-3-7(9(13)14)8(12)4-6;;;;;/h2-4,12H,1H3,(H,10,11)(H,13,14);;4*1H2/q;+2;;;;/p-2 |
| InChIKey | KNWZMFPMRVWYPH-UHFFFAOYSA-L |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 31409M |
| Solvent | Polysol |