| SpectraBase Spectrum ID |
AC46hswFErZ |
| Name |
1-(4'-Chlorophenyl)-3-(4''-methoxyphenyl)-propenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.060407357 u |
| Formula |
C16H13ClO2 |
| InChI |
InChI=1S/C16H13ClO2/c1-19-15-9-2-12(3-10-15)4-11-16(18)13-5-7-14(17)8-6-13/h2-11H,1H3/b11-4+ |
| InChIKey |
KGKFNDADSPFRCJ-NYYWCZLTSA-N |
| SMILES |
C(=O)(\C=C\C1=CC=C(C=C1)OC)C1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877726 |