| SpectraBase Spectrum ID |
HzXt3KiuKSV |
| Name |
8,8-Dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-spiro-1'-cyclohexan-2'-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.198365456 u |
| Formula |
C17H26O |
| InChI |
InChI=1S/C17H26O/c1-16(2)9-5-6-13-8-11-17(12-14(13)16)10-4-3-7-15(17)18/h3-12H2,1-2H3 |
| InChIKey |
POCWDQYCFAMVQT-UHFFFAOYSA-N |
| Molecular Weight |
246.394 g/mol |
| SMILES |
C=12CC3(C(=O)CCCC3)CCC1CCCC2(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893894 |
