| SpectraBase Compound ID | 2xvZt1IXibj |
|---|---|
| InChI | InChI=1S/C22H26BrNO5S2/c1-4-5-6-14-12(2)15-11-16(23)19(26)17(20(15)29-21(14)27)18(25)13(3)31-22(30)24-7-9-28-10-8-24/h11,13,26H,4-10H2,1-3H3 |
| InChIKey | MVECTMVWBXRCIW-UHFFFAOYSA-N |
| Mol Weight | 528.48 g/mol |
| Molecular Formula | C22H26BrNO5S2 |
| Exact Mass | 527.043578 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BgpQBnePxg4 |
|---|---|
| Name | 6-bromo-3-butyl-7-hydroxy-8-(2-mercaptopropionyl)-4-methyl-coumarin-8-(4-morpholinecarbodithioate) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26BrNO5S2 |
| InChI | InChI=1S/C22H26BrNO5S2/c1-4-5-6-14-12(2)15-11-16(23)19(26)17(20(15)29-21(14)27)18(25)13(3)31-22(30)24-7-9-28-10-8-24/h11,13,26H,4-10H2,1-3H3 |
| InChIKey | MVECTMVWBXRCIW-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 52687M |
| Solvent | CDCl3 |