| SpectraBase Spectrum ID |
Lo9f353mQP6 |
| Name |
Naphtho[2,1-B]furan-5,9-diol, dodecahydro-3A,6,6,9A-tetramethyl-2-(1-methyl-1-propenyl)-, [2S-[2.alpha.(E),3A.alpha.,5.alpha.,5A.beta.,9.alpha.,9A.alpha.,9B.beta.]]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.250794952 u |
| Formula |
C20H34O3 |
| InChI |
InChI=1S/C20H34O3/c1-7-12(2)16-15(22)17-19(5,23-16)11-8-13-18(3,4)10-9-14(21)20(13,17)6/h7,13-17,21-22H,8-11H2,1-6H3/b12-7+/t13-,14+,15+,16+,17-,19+,20+/m0/s1 |
| InChIKey |
SPDBGHVIBJGSPV-MZLYOLCLSA-N |
| Molecular Weight |
322.489 g/mol |
| SMILES |
[C@]12([C@@]3([C@@](C(C)(C)CC[C@]3(O)[H])([H])CC[C@]1(O[C@@]([C@]2(O)[H])(\C(=C\C)C)[H])C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941682 |
![Naphtho[2,1-b]furan-5,9-diol, dodecahydro-3a,6,6,9a-tetramethyl-2-(1-methyl-1-propenyl)-, [2S-[2.alpha.(E),3a.alpha.,5.alpha.,5a.beta.,9.alpha.,9a.alpha.,9b.beta.]]-](/api/spectrum/Lo9f353mQP6/structure.png?h=300&w=458 "Naphtho[2,1-b]furan-5,9-diol, dodecahydro-3a,6,6,9a-tetramethyl-2-(1-methyl-1-propenyl)-, [2S-[2.alpha.(E),3a.alpha.,5.alpha.,5a.beta.,9.alpha.,9a.alpha.,9b.beta.]]-")
