| SpectraBase Spectrum ID |
LvibQO32xNH |
| Name |
1,2,4-Trimethyl-4-(1,3,4-trimethylcyclohex-3-en-1-yl)cyclohex-1-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.234750966 u |
| Formula |
C18H30 |
| InChI |
InChI=1S/C18H30/c1-13-7-9-17(5,11-15(13)3)18(6)10-8-14(2)16(4)12-18/h7-12H2,1-6H3 |
| InChIKey |
RUXKSFLGUPWPKK-UHFFFAOYSA-N |
| Molecular Weight |
246.438 g/mol |
| SMILES |
C=1(CC(CCC1C)(C1(CC(=C(CC1)C)C)C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817067 |
