| SpectraBase Spectrum ID |
BfozrtlFexH |
| Name |
1,3-Dimethyl-(3,7-dimethyloctyl)cyclohexane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.281701159 u |
| Formula |
C18H36 |
| InChI |
InChI=1S/C18H36/c1-15(2)8-6-9-16(3)11-13-18(5)12-7-10-17(4)14-18/h15-17H,6-14H2,1-5H3 |
| InChIKey |
DORBINGRHYKJOY-UHFFFAOYSA-N |
| Molecular Weight |
252.486 g/mol |
| SMILES |
C1CC(CC(C1)C)(C)CCC(CCCC(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926114 |
