| SpectraBase Spectrum ID |
IR3IJdhzyA0 |
| Name |
(1-Benzyl-2-phenyl-ethyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.156500644 u |
| Formula |
C21H20 |
| InChI |
InChI=1S/C21H20/c1-4-10-18(11-5-1)16-21(20-14-8-3-9-15-20)17-19-12-6-2-7-13-19/h1-15,21H,16-17H2 |
| InChIKey |
GDPISEKNRFFKMM-UHFFFAOYSA-N |
| Molecular Weight |
272.391 g/mol |
| SMILES |
C(CC1=CC=CC=C1)(CC1=CC=CC=C1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970218 |