SpectraBase Spectrum ID |
AJAkKPl4X0x |
Name |
5-Trityloxy-3(E)-penten-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
342.161979946 u |
Formula |
C24H22O2 |
InChI |
InChI=1S/C24H22O2/c1-20(25)12-11-19-26-24(21-13-5-2-6-14-21,22-15-7-3-8-16-22)23-17-9-4-10-18-23/h2-18H,19H2,1H3/b12-11+ |
InChIKey |
FCYKIZLWCFSXSX-VAWYXSNFSA-N |
Molecular Weight |
342.438 g/mol |
SMILES |
C(C=1C=CC=CC1)(C=1C=CC=CC1)(C=1C=CC=CC1)OC\C=C\C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846293 |