| SpectraBase Spectrum ID |
16SpVKPKraH |
| Name |
1H-Azepine, 1-[[3-(4-fluorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl]hexahydro- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.143056021 u |
| Formula |
C16H19FN2O2 |
| InChI |
InChI=1S/C16H19FN2O2/c17-13-7-5-12(6-8-13)14-11-15(21-18-14)16(20)19-9-3-1-2-4-10-19/h5-8,15H,1-4,9-11H2 |
| InChIKey |
JWNIOYYAIQWUNF-UHFFFAOYSA-N |
| Molecular Weight |
290.338 g/mol |
| SMILES |
C1(C(N2CCCCCC2)=O)ON=C(C1)C=1C=CC(=CC1)F |
![1H-azepine, 1-[[3-(4-fluorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl]hexahydro-](/api/spectrum/16SpVKPKraH/structure.png?h=300&w=458 "1H-azepine, 1-[[3-(4-fluorophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl]hexahydro-")
