SpectraBase Spectrum ID |
BfbghtEQxB4 |
Name |
Methanone, [2-(1-methylethenyl)phenyl]phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
222.104465070 u |
Formula |
C16H14O |
InChI |
InChI=1S/C16H14O/c1-12(2)14-10-6-7-11-15(14)16(17)13-8-4-3-5-9-13/h3-11H,1H2,2H3 |
InChIKey |
PAKXZQDZFQVWDQ-UHFFFAOYSA-N |
Molecular Weight |
222.287 g/mol |
SMILES |
C(=O)(C1=C(C(C)=C)C=CC=C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929815 |