SpectraBase Spectrum ID |
5weievMcDSb |
Name |
1,5-Dicyclohexyl-3-(2'-cyclohexylethyl)pentane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
346.359951481 u |
Formula |
C25H46 |
InChI |
InChI=1S/C25H46/c1-4-10-22(11-5-1)16-19-25(20-17-23-12-6-2-7-13-23)21-18-24-14-8-3-9-15-24/h22-25H,1-21H2 |
InChIKey |
QSDSENYLXAFOHY-UHFFFAOYSA-N |
Molecular Weight |
346.643 g/mol |
SMILES |
C1CCCCC1CCC(CCC1CCCCC1)CCC1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962372 |