| SpectraBase Compound ID | Fmi3MkphqoV |
|---|---|
| InChI | InChI=1S/C20H23FN2O2/c21-17-9-7-16(8-10-17)19(24)6-3-11-22-12-14-23(15-13-22)18-4-1-2-5-20(18)25/h1-2,4-5,7-10,25H,3,6,11-15H2 |
| InChIKey | OVDSHSHOGCRXOM-UHFFFAOYSA-N |
| Mol Weight | 342.41 g/mol |
| Molecular Formula | C20H23FN2O2 |
| Exact Mass | 342.174356 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Ot5509M4q7 |
|---|---|
| Name | Fluanisone-m (o-demethyl-) P1171 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.174356150 u |
| Formula | C20H23FN2O2 |
| InChI | InChI=1S/C20H23FN2O2/c21-17-9-7-16(8-10-17)19(24)6-3-11-22-12-14-23(15-13-22)18-4-1-2-5-20(18)25/h1-2,4-5,7-10,25H,3,6,11-15H2 |
| InChIKey | OVDSHSHOGCRXOM-UHFFFAOYSA-N |
| Molecular Weight | 342.414 g/mol |
| SMILES | C1=CC(=CC=C1C(CCCN1CCN(C=2C=CC=CC2O)CC1)=O)F |