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5-isoxazolecarboxamide, N-(2,6-dichlorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-

View entire compound with spectra: 2 NMR

5-isoxazolecarboxamide, N-(2,6-dichlorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-
SpectraBase Compound ID 4sJZEQo2rMe
InChI InChI=1S/C16H11Cl2FN2O2/c17-11-2-1-3-12(18)15(11)20-16(22)14-8-13(21-23-14)9-4-6-10(19)7-5-9/h1-7,14H,8H2,(H,20,22)
InChIKey ICUUXJBAPPNHEP-UHFFFAOYSA-N
Mol Weight 353.18 g/mol
Molecular Formula C16H11Cl2FN2O2
Exact Mass 352.018161 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IsJ2N9LAEXX
Name 5-Isoxazolecarboxamide, N-(2,6-dichlorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.018161163 u
Formula C16H11Cl2FN2O2
InChI InChI=1S/C16H11Cl2FN2O2/c17-11-2-1-3-12(18)15(11)20-16(22)14-8-13(21-23-14)9-4-6-10(19)7-5-9/h1-7,14H,8H2,(H,20,22)
InChIKey ICUUXJBAPPNHEP-UHFFFAOYSA-N
Molecular Weight 353.180 g/mol
SMILES N(C(C1ON=C(C1)C1=CC=C(C=C1)F)=O)C=1C(Cl)=CC=CC1Cl