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1-piperazineacetamide, 4-(4-chlorophenyl)-N-(2,4-difluorophenyl)-

View entire compound with spectra: 2 NMR

1-piperazineacetamide, 4-(4-chlorophenyl)-N-(2,4-difluorophenyl)-
SpectraBase Compound ID DXLPshpxbAk
InChI InChI=1S/C18H18ClF2N3O/c19-13-1-4-15(5-2-13)24-9-7-23(8-10-24)12-18(25)22-17-6-3-14(20)11-16(17)21/h1-6,11H,7-10,12H2,(H,22,25)
InChIKey BXUOPVRNMSALDC-UHFFFAOYSA-N
Mol Weight 365.81 g/mol
Molecular Formula C18H18ClF2N3O
Exact Mass 365.110646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ePxM5ILqA7
Name 1-Piperazineacetamide, 4-(4-chlorophenyl)-N-(2,4-difluorophenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 365.110646237 u
Formula C18H18ClF2N3O
InChI InChI=1S/C18H18ClF2N3O/c19-13-1-4-15(5-2-13)24-9-7-23(8-10-24)12-18(25)22-17-6-3-14(20)11-16(17)21/h1-6,11H,7-10,12H2,(H,22,25)
InChIKey BXUOPVRNMSALDC-UHFFFAOYSA-N
Molecular Weight 365.812 g/mol
SMILES N(C(CN1CCN(C2=CC=C(C=C2)Cl)CC1)=O)C1=C(C=C(C=C1)F)F