| SpectraBase Compound ID | KHx6fTixfUy |
|---|---|
| InChI | InChI=1S/C20H33IO2/c1-6-18(4)9-7-16-19(5,23-18)10-8-15-17(2,3)11-14(22)12-20(15,16)13-21/h6,14-16,22H,1,7-13H2,2-5H3/t14-,15+,16+,18+,19-,20-/m1/s1 |
| InChIKey | QWJJSYFNJDHLFE-ZHAUUAPESA-N |
| Mol Weight | 432.4 g/mol |
| Molecular Formula | C20H33IO2 |
| Exact Mass | 432.152525 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8l3gdhYXXGt |
|---|---|
| Name | 8.alpha.,13-Epoxyl-20-iodolabdan-14-en-2.beta.-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H33IO2 |
| InChI | InChI=1S/C20H33IO2/c1-6-18(4)9-7-16-19(5,23-18)10-8-15-17(2,3)11-14(22)12-20(15,16)13-21/h6,14-16,22H,1,7-13H2,2-5H3/t14-,15+,16+,18+,19-,20-/m1/s1 |
| InChIKey | QWJJSYFNJDHLFE-ZHAUUAPESA-N |
| Molecular Weight | 432.386 g/mol |
| SMILES | O[C@@]1(CC([C@]2([C@@]([C@@]3([C@@](O[C@](CC3)(C=C)C)(C)CC2)[H])(C1)CI)[H])(C)C)[H] |
| SPLASH | splash10-00kb-0930800000-04a9813653ab376c8745 |
| Source of Spectrum | B-44-487-0 |
| Synonyms | (3R,4aR,6aS,9S,10aS,10bR)-9-iodo-3,4a,7,7,10a-pentamethyl-3-vinyldodecahydro-1H-benzo[f]chromen-9-ol 8a,13-epoxy-2-iodolabd-14-en-2b-ol (3R,4aR,6aS,9R,10aR,10bR)-3-ethenyl-10a-(iodomethyl)-3,4a,7,7-tetramethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f][1]benzopyran-9-ol (3R,4aR,6aS,9R,10aR,10bR)-3-ethenyl-10a-(iodomethyl)-3,4a,7,7-tetramethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-9-ol (3R,4aR,6aS,9R,10aR,10bR)-3-ethenyl-10a-(iodanylmethyl)-3,4a,7,7-tetramethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-9-ol |
| Wiley ID | 1382155 |