| SpectraBase Compound ID | BTj8RdsTnt6 |
|---|---|
| InChI | InChI=1S/C26H46N8O13/c1-10(37)31-17-20(42)19(41)13(8-35)45-24(17)33-15(39)5-6-16(40)47-22-14(9-36)46-25(18(21(22)43)32-11(2)38)34-23(44)12(27)4-3-7-30-26(28)29/h12-14,17-22,24-25,35-36,41-43H,3-9,27H2,1-2H3,(H,31,37)(H,32,38)(H,33,39)(H,34,44)(H4,28,29,30)/p+2/t12-,13+,14-,17+,18-,19+,20+,21-,22-,24+,25-/m1/s1 |
| InChIKey | GHULREVGTYLVMI-HRIFXIHOSA-P |
| Mol Weight | 680.7 g/mol |
| Molecular Formula | C26H48N8O13 |
| Exact Mass | 680.334084 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CPGwWEj2CzY |
|---|---|
| Name | GHULREVGTYLVMI-HRIFXIHOSA-P |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H48N8O13 |
| InChI | InChI=1S/C26H46N8O13/c1-10(37)31-17-20(42)19(41)13(8-35)45-24(17)33-15(39)5-6-16(40)47-22-14(9-36)46-25(18(21(22)43)32-11(2)38)34-23(44)12(27)4-3-7-30-26(28)29/h12-14,17-22,24-25,35-36,41-43H,3-9,27H2,1-2H3,(H,31,37)(H,32,38)(H,33,39)(H,34,44)(H4,28,29,30)/p+2/t12-,13+,14-,17+,18-,19+,20+,21-,22-,24+,25-/m1/s1 |
| InChIKey | GHULREVGTYLVMI-HRIFXIHOSA-P |
| Literature Reference Author | A.GERMER,M.G.PETER,E.KLEINPETER |
| Literature Reference Citation | J.ORG.CHEM.,67,6328(2002) |
| Literature Reference DOI | 10.1021/jo0163703 |
| Molecular Weight | 680.713 g/mol |
| Solvent | Unknown |
| Source File Reference | UWSI21888 |