| SpectraBase Spectrum ID |
6lyKQGpLus0 |
| Name |
1-(2-Benzylcyclopent-1-en-1-yl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.140850580 u |
| Formula |
C18H18 |
| InChI |
InChI=1S/C18H18/c1-3-8-15(9-4-1)14-17-12-7-13-18(17)16-10-5-2-6-11-16/h1-6,8-11H,7,12-14H2 |
| InChIKey |
VXNRBSDMDDKRNG-UHFFFAOYSA-N |
| Molecular Weight |
234.342 g/mol |
| SMILES |
C1(=C(C2=CC=CC=C2)CCC1)CC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982231 |
