| SpectraBase Spectrum ID |
LF0SmjbiAFY |
| Name |
(1-S,2-S,5-R,8-S)-8-Methylene-1,4,4-trimethyltricyclo-[6.2.1.0-(2.5)]-undecan-12-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.198365456 u |
| Formula |
C15H26O |
| InChI |
InChI=1S/C15H26O/c1-13(2)8-12-11(13)4-5-15(10-16)7-6-14(12,3)9-15/h11-12,16H,4-10H2,1-3H3/t11-,12+,14+,15+/m1/s1 |
| InChIKey |
XWABANYWLUFJKU-DHMWGJHJSA-N |
| Molecular Weight |
222.372 g/mol |
| SMILES |
C(O)[C@]12CC[C@@]3([C@@]([C@@](C)(CC2)C1)(CC3(C)C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873196 |
![(1-S,2-S,5-R,8-S)-8-Methylene-1,4,4-trimethyltricyclo-[6.2.1.0-(2.5)]-undecan-12-ol](/api/spectrum/LF0SmjbiAFY/structure.png?h=300&w=458 "(1-S,2-S,5-R,8-S)-8-Methylene-1,4,4-trimethyltricyclo-[6.2.1.0-(2.5)]-undecan-12-ol")
