| SpectraBase Compound ID | HI9xwBf1vwf |
|---|---|
| InChI | InChI=1S/C14H14N2O3S/c1-9(17)12-10(2)19-14(20-12)16-13(18)15-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,15,18)/b16-14+ |
| InChIKey | MHVAZGGWKWCHKG-JQIJEIRASA-N |
| Mol Weight | 290.34 g/mol |
| Molecular Formula | C14H14N2O3S |
| Exact Mass | 290.072513 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ChP2leC5HkO |
|---|---|
| Name | 4-ACETYL-2-BENZYL-CARBAMOYLIMINO-5-METHYL-1,3-OXATHIOLE |
| Compound Number | 4 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C14H14N2O3S/c1-9(17)12-10(2)19-14(20-12)16-13(18)15-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,15,18)/b16-14+ |
| InChIKey | MHVAZGGWKWCHKG-JQIJEIRASA-N |
| Literature Reference | J.CHEM.SOC.PERKIN-1,1263(1994) G.LABBE,J.BUELENS,W.DEHAEN,S.TOPPET,L.VANMEERVELT |
| Solvent | Dimethyl sulfoxide-d6 |