SpectraBase Spectrum ID |
LOdR3OIvAHu |
Name |
3-Cyclohexylbicyclo[2.2.1]heptan-2-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
194.167065327 u |
Formula |
C13H22O |
InChI |
InChI=1S/C13H22O/c14-13-11-7-6-10(8-11)12(13)9-4-2-1-3-5-9/h9-14H,1-8H2/t10-,11+,12-,13-/m0/s1 |
InChIKey |
LMKONKOSDFPPKU-RNJOBUHISA-N |
Molecular Weight |
194.318 g/mol |
SMILES |
C1C[C@@]2([C@@]([C@]([C@]1(C2)[H])(O)[H])(C1CCCCC1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949877 |