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3,4-Dichloro-N-[cyclohexyl(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
SpectraBase Compound ID 7EU0rJR5RXt
InChI InChI=1S/C22H21Cl2N3O2/c23-17-12-11-16(13-18(17)24)21(28)25-19(14-7-3-1-4-8-14)22-26-20(27-29-22)15-9-5-2-6-10-15/h2,5-6,9-14,19H,1,3-4,7-8H2,(H,25,28)
InChIKey CRXJGKZAXKZROE-UHFFFAOYSA-N
Mol Weight 430.34 g/mol
Molecular Formula C22H21Cl2N3O2
Exact Mass 429.101082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 33B9p4TUqY9
Name 3,4-Dichloro-N-[cyclohexyl(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 429.101082326 u
Formula C22H21Cl2N3O2
InChI InChI=1S/C22H21Cl2N3O2/c23-17-12-11-16(13-18(17)24)21(28)25-19(14-7-3-1-4-8-14)22-26-20(27-29-22)15-9-5-2-6-10-15/h2,5-6,9-14,19H,1,3-4,7-8H2,(H,25,28)
InChIKey CRXJGKZAXKZROE-UHFFFAOYSA-N
Molecular Weight 430.335 g/mol
SMILES C(C1=CC(=C(C=C1)Cl)Cl)(=O)NC(C=1ON=C(N1)C1=CC=CC=C1)C1CCCCC1