SpectraBase Spectrum ID |
2pWdvuRLmEB |
Name |
2-(2-Methylpropyl)oxybenzylidene acetophenone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
280.146329882 u |
Formula |
C19H20O2 |
InChI |
InChI=1S/C19H20O2/c1-15(2)14-21-19-11-7-6-10-17(19)12-13-18(20)16-8-4-3-5-9-16/h3-13,15H,14H2,1-2H3/b13-12+ |
InChIKey |
NUSPYKGBCZSVHX-OUKQBFOZSA-N |
SMILES |
C1(=CC=CC=C1)C(\C=C\C=1C=CC=CC1OCC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946011 |