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benzamide, N-[[3-(4-methoxyphenyl)-5-isoxazolyl]methyl]-4-(trifluoromethyl)-
SpectraBase Compound ID BJcBXTgtaxp
InChI InChI=1S/C19H15F3N2O3/c1-26-15-8-4-12(5-9-15)17-10-16(27-24-17)11-23-18(25)13-2-6-14(7-3-13)19(20,21)22/h2-10H,11H2,1H3,(H,23,25)
InChIKey QVZQMKGDUANVJB-UHFFFAOYSA-N
Mol Weight 376.34 g/mol
Molecular Formula C19H15F3N2O3
Exact Mass 376.103477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ir74e2xDRr4
Name Benzamide, N-[[3-(4-methoxyphenyl)-5-isoxazolyl]methyl]-4-(trifluoromethyl)-
Comments Computed using HOSE algorithm
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Exact Mass 376.103476837 u
Formula C19H15F3N2O3
InChI InChI=1S/C19H15F3N2O3/c1-26-15-8-4-12(5-9-15)17-10-16(27-24-17)11-23-18(25)13-2-6-14(7-3-13)19(20,21)22/h2-10H,11H2,1H3,(H,23,25)
InChIKey QVZQMKGDUANVJB-UHFFFAOYSA-N
Molecular Weight 376.335 g/mol
SMILES N(C(=O)C1=CC=C(C=C1)C(F)(F)F)CC1=CC(C=2C=CC(OC)=CC2)=NO1