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acetamide, N-[2-[4-[[4-(2-fluorophenyl)-1-piperazinyl]carbonyl]phenoxy]ethyl]-
SpectraBase Compound ID 72QeZ7LPnJa
InChI InChI=1S/C21H24FN3O3/c1-16(26)23-10-15-28-18-8-6-17(7-9-18)21(27)25-13-11-24(12-14-25)20-5-3-2-4-19(20)22/h2-9H,10-15H2,1H3,(H,23,26)
InChIKey PHLZASNZGLREMI-UHFFFAOYSA-N
Mol Weight 385.44 g/mol
Molecular Formula C21H24FN3O3
Exact Mass 385.18017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2DBkFM6qVvo
Name Acetamide, N-[2-[4-[[4-(2-fluorophenyl)-1-piperazinyl]carbonyl]phenoxy]ethyl]-
Comments Computed using HOSE algorithm
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Exact Mass 385.180169805 u
Formula C21H24FN3O3
InChI InChI=1S/C21H24FN3O3/c1-16(26)23-10-15-28-18-8-6-17(7-9-18)21(27)25-13-11-24(12-14-25)20-5-3-2-4-19(20)22/h2-9H,10-15H2,1H3,(H,23,26)
InChIKey PHLZASNZGLREMI-UHFFFAOYSA-N
Molecular Weight 385.439 g/mol
SMILES N(C(=O)C)CCOC=1C=CC(C(N2CCN(C3=C(F)C=CC=C3)CC2)=O)=CC1