SpectraBase Spectrum ID |
5ktzHCgp56R |
Name |
6-(Hydroxymethyl)-7-methylbicyclo[6.4.0]dodecan-2-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
226.193280075 u |
Formula |
C14H26O2 |
InChI |
InChI=1S/C14H26O2/c1-10-11(9-15)5-4-8-14(16)13-7-3-2-6-12(10)13/h10-16H,2-9H2,1H3 |
InChIKey |
QPEFSCCNGAKIBR-UHFFFAOYSA-N |
Molecular Weight |
226.360 g/mol |
SMILES |
C12C(CCCC(C(C2CCCC1)C)CO)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894675 |