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2-furancarboxamide, 5-(4-chlorophenyl)-N-[4-(1-piperidinyl)phenyl]-
SpectraBase Compound ID 6oe3pLBN6ZF
InChI InChI=1S/C22H21ClN2O2/c23-17-6-4-16(5-7-17)20-12-13-21(27-20)22(26)24-18-8-10-19(11-9-18)25-14-2-1-3-15-25/h4-13H,1-3,14-15H2,(H,24,26)
InChIKey UBJHHWMZQIYYRF-UHFFFAOYSA-N
Mol Weight 380.88 g/mol
Molecular Formula C22H21ClN2O2
Exact Mass 380.129156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HyMdhQrnd5d
Name 2-Furancarboxamide, 5-(4-chlorophenyl)-N-[4-(1-piperidinyl)phenyl]-
Comments Computed using HOSE algorithm
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Exact Mass 380.129155622 u
Formula C22H21ClN2O2
InChI InChI=1S/C22H21ClN2O2/c23-17-6-4-16(5-7-17)20-12-13-21(27-20)22(26)24-18-8-10-19(11-9-18)25-14-2-1-3-15-25/h4-13H,1-3,14-15H2,(H,24,26)
InChIKey UBJHHWMZQIYYRF-UHFFFAOYSA-N
Molecular Weight 380.875 g/mol
SMILES N(C(C=1OC(C=2C=CC(=CC2)Cl)=CC1)=O)C=1C=CC(N2CCCCC2)=CC1