| SpectraBase Compound ID | 1TOQWoPg7UM |
|---|---|
| InChI | InChI=1S/C20H36N4O6S2/c1-15(2)11-17-13-31(27,28)21-9-6-8-20(26)24-18(12-16(3)4)14-32(29,30)22-10-5-7-19(25)23-17/h5-8,15-18,21-22H,9-14H2,1-4H3,(H,23,25)(H,24,26)/b7-5-,8-6-/t17-,18+ |
| InChIKey | MQIDGJJWUVQFNM-LIFHPKKTSA-N |
| Mol Weight | 492.7 g/mol |
| Molecular Formula | C20H36N4O6S2 |
| Exact Mass | 492.207627 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3lW8mJimhGL |
|---|---|
| Name | MQIDGJJWUVQFNM-LIFHPKKTSA-N |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H36N4O6S2 |
| InChI | InChI=1S/C20H36N4O6S2/c1-15(2)11-17-13-31(27,28)21-9-6-8-20(26)24-18(12-16(3)4)14-32(29,30)22-10-5-7-19(25)23-17/h5-8,15-18,21-22H,9-14H2,1-4H3,(H,23,25)(H,24,26)/b7-5-,8-6-/t17-,18+ |
| InChIKey | MQIDGJJWUVQFNM-LIFHPKKTSA-N |
| Literature Reference Author | A.J.BROUWER,R.M.J.LISKAMP |
| Literature Reference Citation | J.ORG.CHEM.,69,3662(2004) |
| Literature Reference DOI | 10.1021/jo0358325 |
| Molecular Weight | 492.649 g/mol |
| Solvent | CDCl3:CD3OD |
| Source File Reference | UWVN21348 |