![(1S)-1-(3"-Hydroxy-1"-octenyl)-5-[(1',1'-dimethylethyl)diphenylsilyloxy]octahydro-2-pentalenyl benzoate](/api/spectrum/JGAT2WPL6f4/structure.png?h=300&w=458 "(1S)-1-(3\"-Hydroxy-1\"-octenyl)-5-[(1',1'-dimethylethyl)diphenylsilyloxy]octahydro-2-pentalenyl benzoate")
| SpectraBase Compound ID | efJBkLsjjM |
|---|---|
| InChI | InChI=1S/C39H50O4Si/c1-5-6-10-19-31(40)24-25-35-36-28-32(26-30(36)27-37(35)42-38(41)29-17-11-7-12-18-29)43-44(39(2,3)4,33-20-13-8-14-21-33)34-22-15-9-16-23-34/h7-9,11-18,20-25,30-32,35-37,40H,5-6,10,19,26-28H2,1-4H3/b25-24+/t30?,31?,32?,35-,36?,37?/m0/s1 |
| InChIKey | QGUKHOVPAQTAFC-BXJKWLRDSA-N |
| Mol Weight | 610.9 g/mol |
| Molecular Formula | C39H50O4Si |
| Exact Mass | 610.347837 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JGAT2WPL6f4 |
|---|---|
| Name | (1S)-1-(3"-Hydroxy-1"-octenyl)-5-[(1',1'-dimethylethyl)diphenylsilyloxy]octahydro-2-pentalenyl benzoate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C39H50O4Si |
| InChI | InChI=1S/C39H50O4Si/c1-5-6-10-19-31(40)24-25-35-36-28-32(26-30(36)27-37(35)42-38(41)29-17-11-7-12-18-29)43-44(39(2,3)4,33-20-13-8-14-21-33)34-22-15-9-16-23-34/h7-9,11-18,20-25,30-32,35-37,40H,5-6,10,19,26-28H2,1-4H3/b25-24+/t30?,31?,32?,35-,36?,37?/m0/s1 |
| InChIKey | QGUKHOVPAQTAFC-BXJKWLRDSA-N |
| Molecular Weight | 610.910 g/mol |
| SMILES | OC(\C=C\[C@]1(C2CC(O[Si](C(C)(C)C)(c3ccccc3)c3ccccc3)CC2CC1OC(=O)c1ccccc1)[H])CCCCC |
| SPLASH | splash10-0aou-0791000000-4be64236d0ba21029362 |
| Source of Spectrum | U1-1998-819-49 |
| Synonyms | (1S)-5-{[tert-butyl(diphenyl)silyl]oxy}-1-[(1E)-3-hydroxy-1-octenyl]octahydro-2-pentalenyl benzoate |
| Wiley ID | 751262 |