SpectraBase Spectrum ID |
A8SRnanFnxr |
Name |
2',5'-Diethyl-3,4-dimethyl-4',6'-diphenyl-m-terphenyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
466.266051095 u |
Formula |
C36H34 |
InChI |
InChI=1S/C36H34/c1-5-31-33(27-16-10-7-11-17-27)34(28-18-12-8-13-19-28)32(6-2)36(30-23-22-25(3)26(4)24-30)35(31)29-20-14-9-15-21-29/h7-24H,5-6H2,1-4H3 |
InChIKey |
HPTRVUPGGQNFHT-UHFFFAOYSA-N |
Molecular Weight |
466.668 g/mol |
SMILES |
C1=CC(=CC=C1)C1=C(C(=C(C(=C1C=1C=CC=CC1)CC)C=1C=CC=CC1)C=1C=C(C(=CC1)C)C)CC |
Spectrum/Structure Validation Score (Raman) |
0.809185 |