| SpectraBase Compound ID | CQZqYtBqnzF |
|---|---|
| InChI | InChI=1S/C35H36Cl2N2O6S2/c1-42-28-11-7-24(36)19-26(28)34(40)38-15-13-22-5-9-30(44-3)32(17-22)46-21-47-33-18-23(6-10-31(33)45-4)14-16-39-35(41)27-20-25(37)8-12-29(27)43-2/h5-12,17-20H,13-16,21H2,1-4H3,(H,38,40)(H,39,41) |
| InChIKey | DQFKHDMRMMPCTI-UHFFFAOYSA-N |
| Mol Weight | 715.7 g/mol |
| Molecular Formula | C35H36Cl2N2O6S2 |
| Exact Mass | 714.139185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8EFeN7pvEWi |
|---|---|
| Name | DQFKHDMRMMPCTI-UHFFFAOYSA-N |
| Compound Number | 2162 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H36Cl2N2O6S2 |
| InChI | InChI=1S/C35H36Cl2N2O6S2/c1-42-28-11-7-24(36)19-26(28)34(40)38-15-13-22-5-9-30(44-3)32(17-22)46-21-47-33-18-23(6-10-31(33)45-4)14-16-39-35(41)27-20-25(37)8-12-29(27)43-2/h5-12,17-20H,13-16,21H2,1-4H3,(H,38,40)(H,39,41) |
| InChIKey | DQFKHDMRMMPCTI-UHFFFAOYSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 715.707 g/mol |
| Sample ID | 2541 |
| Solvent | DMSO-D6 |