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5-isoxazolecarboxamide, 3-(4-fluorophenyl)-4,5-dihydro-N-(1-phenylethyl)-

View entire compound with spectra: 2 NMR

5-isoxazolecarboxamide, 3-(4-fluorophenyl)-4,5-dihydro-N-(1-phenylethyl)-
SpectraBase Compound ID 3O3MtathxBP
InChI InChI=1S/C18H17FN2O2/c1-12(13-5-3-2-4-6-13)20-18(22)17-11-16(21-23-17)14-7-9-15(19)10-8-14/h2-10,12,17H,11H2,1H3,(H,20,22)
InChIKey CSBOPSYQDDROIM-UHFFFAOYSA-N
Mol Weight 312.34 g/mol
Molecular Formula C18H17FN2O2
Exact Mass 312.127406 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID QsBROJXkGV
Name 5-Isoxazolecarboxamide, 3-(4-fluorophenyl)-4,5-dihydro-N-(1-phenylethyl)-
Comments Computed using HOSE algorithm
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Exact Mass 312.127405956 u
Formula C18H17FN2O2
InChI InChI=1S/C18H17FN2O2/c1-12(13-5-3-2-4-6-13)20-18(22)17-11-16(21-23-17)14-7-9-15(19)10-8-14/h2-10,12,17H,11H2,1H3,(H,20,22)
InChIKey CSBOPSYQDDROIM-UHFFFAOYSA-N
Molecular Weight 312.344 g/mol
SMILES N(C(C1ON=C(C1)C=1C=CC(=CC1)F)=O)C(C=1C=CC=CC1)C