| SpectraBase Compound ID | L10gPHyG2zs |
|---|---|
| InChI | InChI=1S/C28H40N2O10S2/c1-19-9-13-21(14-10-19)41(33,34)37-17-23(29-25(31)39-27(3,4)5)24(30-26(32)40-28(6,7)8)18-38-42(35,36)22-15-11-20(2)12-16-22/h9-16,23-24H,17-18H2,1-8H3,(H,29,31)(H,30,32)/t23-,24-/m1/s1 |
| InChIKey | BZLYZTAKBUFULK-DNQXCXABSA-N |
| Mol Weight | 628.8 g/mol |
| Molecular Formula | C28H40N2O10S2 |
| Exact Mass | 628.212438 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5LIh5yp8pIc |
|---|---|
| Name | BZLYZTAKBUFULK-DNQXCXABSA-N |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40N2O10S2 |
| InChI | InChI=1S/C28H40N2O10S2/c1-19-9-13-21(14-10-19)41(33,34)37-17-23(29-25(31)39-27(3,4)5)24(30-26(32)40-28(6,7)8)18-38-42(35,36)22-15-11-20(2)12-16-22/h9-16,23-24H,17-18H2,1-8H3,(H,29,31)(H,30,32)/t23-,24-/m1/s1 |
| InChIKey | BZLYZTAKBUFULK-DNQXCXABSA-N |
| Literature Reference Author | S.H.LEE,H.KOHN |
| Literature Reference Citation | J.AM.CHEM.SOC.,126,4281(2004) |
| Literature Reference DOI | 10.1021/ja030577r |
| Molecular Weight | 628.753 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ24294 |