SpectraBase Spectrum ID |
2BaOMoBrDim |
Name |
1-Methyl-4-[1-(4-methylphenyl)ethyl]benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
210.140850580 u |
Formula |
C16H18 |
InChI |
InChI=1S/C16H18/c1-12-4-8-15(9-5-12)14(3)16-10-6-13(2)7-11-16/h4-11,14H,1-3H3 |
InChIKey |
IDONYCOFOUUWLB-UHFFFAOYSA-N |
Molecular Weight |
210.320 g/mol |
SMILES |
C(C1=CC=C(C=C1)C)(C=1C=CC(=CC1)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955615 |