| SpectraBase Spectrum ID |
GAhmeQ7lXoo |
| Name |
1,2-Benzenediol, o-acetoxyacetyl-o'-(3-fluorobenzoyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.069616296 u |
| Formula |
C17H13FO6 |
| InChI |
InChI=1S/C17H13FO6/c1-11(19)22-10-16(20)23-14-7-2-3-8-15(14)24-17(21)12-5-4-6-13(18)9-12/h2-9H,10H2,1H3 |
| InChIKey |
JDSZEMRMQKTWNV-UHFFFAOYSA-N |
| Molecular Weight |
332.283 g/mol |
| SMILES |
C1=CC=C(C=C1F)C(OC1=CC=CC=C1OC(=O)COC(C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949347 |
