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1-{[3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-2-ethylpiperidine
SpectraBase Compound ID FfoS6NBlXEN
InChI InChI=1S/C18H20Cl2N2O2/c1-3-12-7-4-5-10-22(12)18(23)15-11(2)24-21-17(15)16-13(19)8-6-9-14(16)20/h6,8-9,12H,3-5,7,10H2,1-2H3
InChIKey LNGMHFCRZNIVBN-UHFFFAOYSA-N
Mol Weight 367.28 g/mol
Molecular Formula C18H20Cl2N2O2
Exact Mass 366.090183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EKkclRPlqox
Name 1-{[3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-2-ethylpiperidine
Comments Computed using HOSE algorithm
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Exact Mass 366.090183290 u
Formula C18H20Cl2N2O2
InChI InChI=1S/C18H20Cl2N2O2/c1-3-12-7-4-5-10-22(12)18(23)15-11(2)24-21-17(15)16-13(19)8-6-9-14(16)20/h6,8-9,12H,3-5,7,10H2,1-2H3
InChIKey LNGMHFCRZNIVBN-UHFFFAOYSA-N
Molecular Weight 367.276 g/mol
SMILES C=1(C(=NOC1C)C=1C(Cl)=CC=CC1Cl)C(N1C(CC)CCCC1)=O