![Benzo[1,3]dioxol-5-yl-(4-fluorophenyl)methanone](/api/spectrum/9WycKkOtGJP/structure.png?h=300&w=458 "Benzo[1,3]dioxol-5-yl-(4-fluorophenyl)methanone")
| SpectraBase Compound ID | 1tgEeKy1g3u |
|---|---|
| InChI | InChI=1S/C14H9FO3/c15-11-4-1-9(2-5-11)14(16)10-3-6-12-13(7-10)18-8-17-12/h1-7H,8H2 |
| InChIKey | KDESXURKDJAFFY-UHFFFAOYSA-N |
| Mol Weight | 244.22 g/mol |
| Molecular Formula | C14H9FO3 |
| Exact Mass | 244.053572 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9WycKkOtGJP |
|---|---|
| Name | Benzo[1,3]dioxol-5-yl-(4-fluorophenyl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.053572310 u |
| Formula | C14H9FO3 |
| InChI | InChI=1S/C14H9FO3/c15-11-4-1-9(2-5-11)14(16)10-3-6-12-13(7-10)18-8-17-12/h1-7H,8H2 |
| InChIKey | KDESXURKDJAFFY-UHFFFAOYSA-N |
| Molecular Weight | 244.221 g/mol |
| SMILES | C(=O)(C=1C=CC(=CC1)F)C=1C=C2OCOC2=CC1 |