| SpectraBase Compound ID | EFBjbDM34Mb |
|---|---|
| InChI | InChI=1S/C17H15FO4/c1-11(2)16(19)21-14-9-5-6-10-15(14)22-17(20)12-7-3-4-8-13(12)18/h3-11H,1-2H3 |
| InChIKey | RHCPHKUETHHOQY-UHFFFAOYSA-N |
| Mol Weight | 302.3 g/mol |
| Molecular Formula | C17H15FO4 |
| Exact Mass | 302.095437 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | NMMRthbq7H |
|---|---|
| Name | 1,2-Benzendiol, o-(2-fluorobenzoyl)-o'-isobutyryl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.095437122 u |
| Formula | C17H15FO4 |
| InChI | InChI=1S/C17H15FO4/c1-11(2)16(19)21-14-9-5-6-10-15(14)22-17(20)12-7-3-4-8-13(12)18/h3-11H,1-2H3 |
| InChIKey | RHCPHKUETHHOQY-UHFFFAOYSA-N |
| Molecular Weight | 302.301 g/mol |
| SMILES | C1(=CC=CC=C1OC(=O)C1=CC=CC=C1F)OC(C(C)C)=O |