SpectraBase Spectrum ID |
Ha1iDPUKjXz |
Name |
2-Chloro-2'-hydroxy-4'-methylbenzophenone, acetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
288.055321976 u |
Formula |
C16H13ClO3 |
InChI |
InChI=1S/C16H13ClO3/c1-10-7-8-13(15(9-10)20-11(2)18)16(19)12-5-3-4-6-14(12)17/h3-9H,1-2H3 |
InChIKey |
SZQVIOFSYBLJLI-UHFFFAOYSA-N |
SMILES |
C1(Cl)=C(C=CC=C1)C(=O)C1=C(C=C(C=C1)C)OC(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90484 |