| SpectraBase Spectrum ID |
2AMYQFu4OPL |
| Name |
1,2-Benzenediol, o-(4-fluorobenzoyl)-o'-phenylacetyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.095437122 u |
| Formula |
C21H15FO4 |
| InChI |
InChI=1S/C21H15FO4/c22-17-12-10-16(11-13-17)21(24)26-19-9-5-4-8-18(19)25-20(23)14-15-6-2-1-3-7-15/h1-13H,14H2 |
| InChIKey |
FOBCRBGSSTUWEH-UHFFFAOYSA-N |
| Molecular Weight |
350.345 g/mol |
| SMILES |
C1=CC=C(C=C1)CC(OC=1C(=CC=CC1)OC(=O)C1=CC=C(C=C1)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94923 |
