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Fendiline, N-trifluoroacetyl-

View entire compound with spectra: 1 NMR

Fendiline, N-trifluoroacetyl-
SpectraBase Compound ID 80XDAFTCZ8K
InChI InChI=1S/C25H24F3NO/c1-19(20-11-5-2-6-12-20)29(24(30)25(26,27)28)18-17-23(21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23H,17-18H2,1H3
InChIKey FVGBBNQRJCSASZ-UHFFFAOYSA-N
Mol Weight 411.47 g/mol
Molecular Formula C25H24F3NO
Exact Mass 411.180999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 29OXLbioIFV
Name Fendiline, N-trifluoroacetyl-
Comments Computed using HOSE algorithm
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Exact Mass 411.180998885 u
Formula C25H24F3NO
InChI InChI=1S/C25H24F3NO/c1-19(20-11-5-2-6-12-20)29(24(30)25(26,27)28)18-17-23(21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23H,17-18H2,1H3
InChIKey FVGBBNQRJCSASZ-UHFFFAOYSA-N
Molecular Weight 411.468 g/mol
SMILES C1=CC=C(C=C1)C(N(CCC(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)C(F)(F)F)C