| SpectraBase Spectrum ID |
9JNdn7KRsdN |
| Name |
(2R,4S,6S,8S)-4-Allyl-2-cyclohexyl-8-((methoxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.245709571 u |
| Formula |
C20H34O4 |
| InChI |
InChI=1S/C20H34O4/c1-3-11-19(21)13-18(16-8-5-4-6-9-16)24-20(15-19)12-7-10-17(23-20)14-22-2/h3,16-18,21H,1,4-15H2,2H3/t17-,18+,19-,20+/m0/s1 |
| InChIKey |
NNKITLOIYYZSQQ-ZGXWSNOMSA-N |
| Molecular Weight |
338.488 g/mol |
| SMILES |
[C@@]1(O[C@@]2(O[C@@](CCC2)(COC)[H])C[C@](O)(CC=C)C1)(C1CCCCC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.819084 |
![(2R,4S,6S,8S)-4-Allyl-2-cyclohexyl-8-((methoxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-ol](/api/spectrum/9JNdn7KRsdN/structure.png?h=300&w=458 "(2R,4S,6S,8S)-4-Allyl-2-cyclohexyl-8-((methoxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-ol")
