| SpectraBase Spectrum ID |
AaG5A5zbbLs |
| Name |
Benzene, (4-cyclohexyl-1-cyclohexen-1-yl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.187800773 u |
| Formula |
C18H24 |
| InChI |
InChI=1S/C18H24/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h1,3-4,7-8,11,16,18H,2,5-6,9-10,12-14H2 |
| InChIKey |
FQSAMQQQDMFRFC-UHFFFAOYSA-N |
| Molecular Weight |
240.390 g/mol |
| SMILES |
C1(CCC(=CC1)C1=CC=CC=C1)C1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.836861 |
