| SpectraBase Spectrum ID |
CrlFCwunN1P |
| Name |
2-Methyl-5-(2,6,6-trimethyl-cyclohex-1-enyl)-pentane-2,3-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.208930140 u |
| Formula |
C15H28O2 |
| InChI |
InChI=1S/C15H28O2/c1-11-7-6-10-14(2,3)12(11)8-9-13(16)15(4,5)17/h13,16-17H,6-10H2,1-5H3 |
| InChIKey |
NYKSPYVEKDKOLX-UHFFFAOYSA-N |
| Molecular Weight |
240.387 g/mol |
| SMILES |
C1C(C)=C(CCC(C(O)(C)C)O)C(CC1)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970605 |
