| SpectraBase Spectrum ID |
LkN6IamjDqT |
| Name |
exo-1,5-Diphenylbicyclo[2.1.1]hexane |
| 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/c1-3-7-14(8-4-1)17-15-11-12-18(17,13-15)16-9-5-2-6-10-16/h1-10,15,17H,11-13H2 |
| InChIKey |
ZCYWVSJLAQOEBW-UHFFFAOYSA-N |
| Molecular Weight |
234.342 g/mol |
| SMILES |
C12(C(C3=CC=CC=C3)C(C1)CC2)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92315 |
![exo-1,5-Diphenylbicyclo[2.1.1]hexane](/api/spectrum/LkN6IamjDqT/structure.png?h=300&w=458 "exo-1,5-Diphenylbicyclo[2.1.1]hexane")
