| SpectraBase Compound ID | AsUpKGx1gYO |
|---|---|
| InChI | InChI=1S/C20H22N2O6S/c1-10-7-13(11-3-5-12(27-2)6-4-11)14(8-21)20(29)22(10)19-18(26)17(25)16(24)15(9-23)28-19/h3-7,15-19,23-26H,9H2,1-2H3/t15-,16+,17+,18-,19-/m1/s1 |
| InChIKey | NTZABGIKZBEEJL-ICBNADEASA-N |
| Mol Weight | 418.46 g/mol |
| Molecular Formula | C20H22N2O6S |
| Exact Mass | 418.119858 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HVn2ZSkVF2K |
|---|---|
| Name | 1,2-dihydro-1-(beta-D-galacetopyranosyl)-4-(p-methoxyphenyl)-6-methyl-2-thioxonicotinonitrile |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H22N2O6S |
| InChI | InChI=1S/C20H22N2O6S/c1-10-7-13(11-3-5-12(27-2)6-4-11)14(8-21)20(29)22(10)19-18(26)17(25)16(24)15(9-23)28-19/h3-7,15-19,23-26H,9H2,1-2H3/t15-,16+,17+,18-,19-/m1/s1 |
| InChIKey | NTZABGIKZBEEJL-ICBNADEASA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61431M |
| Solvent | DMSO-d6 |