| SpectraBase Compound ID | Cuop0d7mMjD |
|---|---|
| InChI | InChI=1S/C17H18BrNO4S2/c1-4-19(5-2)17(24)25-8-12(21)13-11(20)7-6-10-9(3)14(18)16(22)23-15(10)13/h6-7,20H,4-5,8H2,1-3H3 |
| InChIKey | CGZNQLKXRUSGOX-UHFFFAOYSA-N |
| Mol Weight | 444.36 g/mol |
| Molecular Formula | C17H18BrNO4S2 |
| Exact Mass | 442.986063 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GO2CnM1CyMt |
|---|---|
| Name | 3-bromo-7-hydroxy-8-(mercaptoacetyl)-4-methylcoumarin, 8-(diethyldithiocarbamate) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H18BrNO4S2 |
| InChI | InChI=1S/C17H18BrNO4S2/c1-4-19(5-2)17(24)25-8-12(21)13-11(20)7-6-10-9(3)14(18)16(22)23-15(10)13/h6-7,20H,4-5,8H2,1-3H3 |
| InChIKey | CGZNQLKXRUSGOX-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 52766M |
| Solvent | Polysol |