SpectraBase Spectrum ID |
Cqy8gxUoDJY |
Name |
(E)-(1-(4-Tert-butylphenyl)ethene-1,2-diyl)dibenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
312.187800773 u |
Formula |
C24H24 |
InChI |
InChI=1S/C24H24/c1-24(2,3)22-16-14-21(15-17-22)23(20-12-8-5-9-13-20)18-19-10-6-4-7-11-19/h4-18H,1-3H3/b23-18+ |
InChIKey |
ZTTXNYLGYPPEPU-PTGBLXJZSA-N |
SMILES |
C1(\C=C\(C=2C=CC(=CC2)C(C)(C)C)C2=CC=CC=C2)=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950886 |