![(1''S,2S,2'R,6'R,8'S,9'S,11'R)-4-(2-(3',4'-EPOXY-3'-METHYL-1'-BUTYL)-OXY]-METHYL)-PROPYL]-9',11'-DIMETHYL-1',7'-DIOXASPIRO-[5.5]-UNDEC-4'-EN-2'-YL]-1-IODO-2-MET](/api/spectrum/Ej5b9CCszdU/structure.png?h=300&w=458 "(1''S,2S,2'R,6'R,8'S,9'S,11'R)-4-(2-(3',4'-EPOXY-3'-METHYL-1'-BUTYL)-OXY]-METHYL)-PROPYL]-9',11'-DIMETHYL-1',7'-DIOXASPIRO-[5.5]-UNDEC-4'-EN-2'-YL]-1-IODO-2-MET")
| SpectraBase Compound ID | AC2CXwmRxWq |
|---|---|
| InChI | InChI=1S/C36H53IO4Si/c1-8-29(25-39-42(34(4,5)6,31-17-11-9-12-18-31)32-19-13-10-14-20-32)33-27(2)24-28(3)36(41-33)22-15-16-30(40-36)21-23-35(7,38)26-37/h9-15,17-20,22,27-30,33,38H,8,16,21,23-26H2,1-7H3/t27?,28?,29?,30-,33?,35-,36+/m1/s1 |
| InChIKey | VQPZBPMOOJTCEN-QPEOHMGVSA-N |
| Mol Weight | 704.8 g/mol |
| Molecular Formula | C36H53IO4Si |
| Exact Mass | 704.275782 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ej5b9CCszdU |
|---|---|
| Name | (1''S,2S,2'R,6'R,8'S,9'S,11'R)-4-(2-(3',4'-EPOXY-3'-METHYL-1'-BUTYL)-OXY]-METHYL)-PROPYL]-9',11'-DIMETHYL-1',7'-DIOXASPIRO-[5.5]-UNDEC-4'-EN-2'-YL]-1-IODO-2-MET |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H53IO4Si |
| InChI | InChI=1S/C36H53IO4Si/c1-8-29(25-39-42(34(4,5)6,31-17-11-9-12-18-31)32-19-13-10-14-20-32)33-27(2)24-28(3)36(41-33)22-15-16-30(40-36)21-23-35(7,38)26-37/h9-15,17-20,22,27-30,33,38H,8,16,21,23-26H2,1-7H3/t27?,28?,29?,30-,33?,35-,36+/m1/s1 |
| InChIKey | VQPZBPMOOJTCEN-QPEOHMGVSA-N |
| Literature Reference Author | M.A.BRIMBLE,G.M.WILLIAMS |
| Literature Reference Citation | J.ORG.CHEM.,57,5818(1992) |
| Literature Reference DOI | 10.1021/jo00048a009 |
| Molecular Weight | 704.804 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS2358 |