SpectraBase Spectrum ID |
2JNYS7qFFyY |
Name |
2,2'-Dibutyl-3,4',5'-trimethyl-1,1'-biphenyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
308.250401030 u |
Formula |
C23H32 |
InChI |
InChI=1S/C23H32/c1-6-8-10-20-15-17(3)12-13-22(20)23-16-18(4)14-19(5)21(23)11-9-7-2/h12-16H,6-11H2,1-5H3 |
InChIKey |
VWROBNGYMVOLGZ-UHFFFAOYSA-N |
SMILES |
C=1(C=2C(=CC(=CC2)C)CCCC)C(=C(C)C=C(C1)C)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.874655 |