| SpectraBase Compound ID | 8LXpYbBOejo |
|---|---|
| InChI | InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)/p+1 |
| InChIKey | DDRJAANPRJIHGJ-UHFFFAOYSA-O |
| Mol Weight | 114.13 g/mol |
| Molecular Formula | C4H8N3O |
| Exact Mass | 114.066737 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4vNShKK6qGM |
|---|---|
| Name | Creatininium cation |
| Comments | MEASURED AS HYDROCHLORIDE |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C4H8N3O |
| InChI | InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)/p+1 |
| InChIKey | DDRJAANPRJIHGJ-UHFFFAOYSA-O |
| Instrument Name | Varian CFT-20 |
| Literature Reference | R.L. Smith, D.W. Cochran, P.Gund, J. Am. Chem. Soc. 101, 191 (1979). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |