| SpectraBase Spectrum ID |
7v9DDB1iEEP |
| Name |
6-Hydroxyflavanone, chlorodifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.031392856 u |
| Formula |
C17H11ClF2O4 |
| InChI |
InChI=1S/C17H11ClF2O4/c18-17(19,20)16(22)23-11-6-7-14-12(8-11)13(21)9-15(24-14)10-4-2-1-3-5-10/h1-8,15H,9H2 |
| InChIKey |
UHUFRPPCIHPRKX-UHFFFAOYSA-N |
| Molecular Weight |
352.721 g/mol |
| SMILES |
C1=C(C=CC=C1)C1CC(C2=CC(=CC=C2O1)OC(C(F)(F)Cl)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932414 |
