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Nicotinamide, N-(4-fluorophenyl)-2-(4-fluorophenylamino)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Nicotinamide, N-(4-fluorophenyl)-2-(4-fluorophenylamino)-
SpectraBase Compound ID EbwCNDYv9KY
InChI InChI=1S/C18H13F2N3O/c19-12-3-7-14(8-4-12)22-17-16(2-1-11-21-17)18(24)23-15-9-5-13(20)6-10-15/h1-11H,(H,21,22)(H,23,24)
InChIKey PAHOYNMTEPZYQS-UHFFFAOYSA-N
Mol Weight 325.32 g/mol
Molecular Formula C18H13F2N3O
Exact Mass 325.102668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 98RQkrxBuXF
Name Nicotinamide, N-(4-fluorophenyl)-2-(4-fluorophenylamino)-
Comments Computed using HOSE algorithm
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Exact Mass 325.102668376 u
Formula C18H13F2N3O
InChI InChI=1S/C18H13F2N3O/c19-12-3-7-14(8-4-12)22-17-16(2-1-11-21-17)18(24)23-15-9-5-13(20)6-10-15/h1-11H,(H,21,22)(H,23,24)
InChIKey PAHOYNMTEPZYQS-UHFFFAOYSA-N
Molecular Weight 325.319 g/mol
SMILES C(C1=C(NC=2C=CC(=CC2)F)N=CC=C1)(NC=1C=CC(=CC1)F)=O