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3-(2,6-dichlorophenyl)-N-[3-(dimethylamino)propyl]-5-methyl-4-isoxazolecarboxamide

View entire compound with spectra: 2 NMR

3-(2,6-dichlorophenyl)-N-[3-(dimethylamino)propyl]-5-methyl-4-isoxazolecarboxamide
SpectraBase Compound ID CKnVTnh2EvG
InChI InChI=1S/C16H19Cl2N3O2/c1-10-13(16(22)19-8-5-9-21(2)3)15(20-23-10)14-11(17)6-4-7-12(14)18/h4,6-7H,5,8-9H2,1-3H3,(H,19,22)
InChIKey BKSRACMSZUWSTO-UHFFFAOYSA-N
Mol Weight 356.25 g/mol
Molecular Formula C16H19Cl2N3O2
Exact Mass 355.085432 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7FnySurIrST
Name 3-(2,6-Dichlorophenyl)-N-[3-(dimethylamino)propyl]-5-methyl-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.085432262 u
Formula C16H19Cl2N3O2
InChI InChI=1S/C16H19Cl2N3O2/c1-10-13(16(22)19-8-5-9-21(2)3)15(20-23-10)14-11(17)6-4-7-12(14)18/h4,6-7H,5,8-9H2,1-3H3,(H,19,22)
InChIKey BKSRACMSZUWSTO-UHFFFAOYSA-N
Molecular Weight 356.253 g/mol
SMILES N(C(C=1C(=NOC1C)C1=C(Cl)C=CC=C1Cl)=O)CCCN(C)C