SpectraBase Spectrum ID |
2Mz3a9b6FG8 |
Name |
1-[(Z)-1-Tolyl-1-butenyl]-2-(1-tolylethenyl)benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
338.203450837 u |
Formula |
C26H26 |
InChI |
InChI=1S/C26H26/c1-5-12-25(23-16-9-7-14-20(23)3)26-18-11-10-17-24(26)21(4)22-15-8-6-13-19(22)2/h6-18H,4-5H2,1-3H3/b25-12- |
InChIKey |
HKTCGNYRPHFRFP-ROTLSHHCSA-N |
Molecular Weight |
338.494 g/mol |
SMILES |
C=1(C(=CC=CC1)\C(=C/CC)C1=CC=CC=C1C)C(C1=C(C=CC=C1)C)=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830607 |