SpectraBase Spectrum ID |
8s4BlN7gdsA |
Name |
(cis,Anti,cis)-11-hydroxymethyl 1,4,4-trimethyltricyclo[6.3.0.0(2,6)]undecane |
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/c1-14(2)7-10-6-11-4-5-12(9-16)15(11,3)13(10)8-14/h10-13,16H,4-9H2,1-3H3/t10-,11+,12?,13+,15-/m0/s1 |
InChIKey |
HUERNPRWUQYJDZ-BKELEFPXSA-N |
Molecular Weight |
222.372 g/mol |
SMILES |
[C@@]12([C@]3([C@@](CC(C3)(C)C)([H])C[C@]1(CCC2CO)[H])[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847325 |