| SpectraBase Compound ID | CjTyqkfDTI0 |
|---|---|
| InChI | InChI=1S/C29H50O/c1-19(30)20-11-16-26(4)21(20)12-17-28(6)23(26)9-10-24-27(5)15-8-14-25(2,3)22(27)13-18-29(24,28)7/h19-24,30H,8-18H2,1-7H3/t19-,20+,21?,22?,23?,24?,26+,27+,28-,29-/m1/s1 |
| InChIKey | OZLVIJDGMACLBA-KEDSIAJSSA-N |
| Mol Weight | 414.7 g/mol |
| Molecular Formula | C29H50O |
| Exact Mass | 414.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6YCzGB2nI8N |
|---|---|
| Name | Isoadiantol B (22S)-30-norisohopan-22-ol) |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H50O |
| InChI | InChI=1S/C29H50O/c1-19(30)20-11-16-26(4)21(20)12-17-28(6)23(26)9-10-24-27(5)15-8-14-25(2,3)22(27)13-18-29(24,28)7/h19-24,30H,8-18H2,1-7H3/t19-,20+,21?,22?,23?,24?,26+,27+,28-,29-/m1/s1 |
| InChIKey | OZLVIJDGMACLBA-KEDSIAJSSA-N |
| Molecular Weight | 414.718 g/mol |
| SMILES | O[C@@]([C@]1(C2CC[C@]3([C@]4(C([C@]5(CCCC(C5CC4)(C)C)C)CCC3[C@]2(CC1)C)C)C)[H])(C)[H] |
| SPLASH | splash10-0006-0901000000-ea8683285dc89ff99963 |
| Source of Spectrum | E1-41-265-3 |
| Wiley ID | 1551898 |