![Ethyl 1-{(S)-2-[(1R,3aS,7aR,E)-4-((E)-2-{(3S,5R)-3,5-Bis[(tert-butyldimethylsilyl)oxy]-2-methylenecyclohexylidene}ethylidene)-7a-methyloctahydro-1H-inden-1-yl]propyl}-1H-tetrazole-5-carboxylate](/api/spectrum/EsTDftIBdhA/structure.png?h=300&w=458 "Ethyl 1-{(S)-2-[(1R,3aS,7aR,E)-4-((E)-2-{(3S,5R)-3,5-Bis[(tert-butyldimethylsilyl)oxy]-2-methylenecyclohexylidene}ethylidene)-7a-methyloctahydro-1H-inden-1-yl]propyl}-1H-tetrazole-5-carboxylate")
| SpectraBase Compound ID | FfXcIhlQAWd |
|---|---|
| InChI | InChI=1S/C38H66N4O4Si2/c1-15-44-35(43)34-39-40-41-42(34)25-26(2)31-20-21-32-28(17-16-22-38(31,32)10)18-19-29-23-30(45-47(11,12)36(4,5)6)24-33(27(29)3)46-48(13,14)37(7,8)9/h18-19,26,30-33H,3,15-17,20-25H2,1-2,4-14H3/b28-18+,29-19+/t26-,30-,31-,32+,33+,38-/m1/s1 |
| InChIKey | LLMNZDLSKRHHLT-RKHKWXJZSA-N |
| Mol Weight | 699.1 g/mol |
| Molecular Formula | C38H66N4O4Si2 |
| Exact Mass | 698.46226 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EsTDftIBdhA |
|---|---|
| Name | Ethyl 1-{(S)-2-[(1R,3aS,7aR,E)-4-((E)-2-{(3S,5R)-3,5-Bis[(tert-butyldimethylsilyl)oxy]-2-methylenecyclohexylidene}ethylidene)-7a-methyloctahydro-1H-inden-1-yl]propyl}-1H-tetrazole-5-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H66N4O4Si2 |
| InChI | InChI=1S/C38H66N4O4Si2/c1-15-44-35(43)34-39-40-41-42(34)25-26(2)31-20-21-32-28(17-16-22-38(31,32)10)18-19-29-23-30(45-47(11,12)36(4,5)6)24-33(27(29)3)46-48(13,14)37(7,8)9/h18-19,26,30-33H,3,15-17,20-25H2,1-2,4-14H3/b28-18+,29-19+/t26-,30-,31-,32+,33+,38-/m1/s1 |
| InChIKey | LLMNZDLSKRHHLT-RKHKWXJZSA-N |
| Molecular Weight | 699.140 g/mol |
| SMILES | c1([n](nnn1)C[C@]([C@@]1([C@@]2([C@](\C(=C\C=C\3C([C@@](O[Si](C(C)(C)C)(C)C)(C[C@@](C3)(O[Si](C(C)(C)C)(C)C)[H])[H])=C)CCC2)(CC1)[H])C)[H])(C)[H])C(=O)OCC |
| SPLASH | splash10-0002-0090122000-170195139cd13053fda1 |
| Source of Spectrum | F4-43-3890-18 |
| Wiley ID | 1706647 |