| SpectraBase Spectrum ID |
IXpDMQrSC97 |
| Name |
(1R,4R)-1-Methyl-4-[(1S)-1,2,2-trimethylcyclopentyl]-1-cyclohex-2-enol |
| 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)8-5-9-15(13,4)12-6-10-14(3,16)11-7-12/h6,10,12,16H,5,7-9,11H2,1-4H3/t12-,14-,15-/m0/s1 |
| InChIKey |
SGAVEYGCXUNESW-QEJZJMRPSA-N |
| Molecular Weight |
222.372 g/mol |
| SMILES |
[C@]1(C(CCC1)(C)C)([C@]1(C=C[C@@](CC1)(O)C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937652 |
![(1R,4R)-1-methyl-4-[(1S)-1,2,2-trimethylcyclopentyl]-1-cyclohex-2-enol](/api/spectrum/IXpDMQrSC97/structure.png?h=300&w=458 "(1R,4R)-1-methyl-4-[(1S)-1,2,2-trimethylcyclopentyl]-1-cyclohex-2-enol")
