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1-(2-Phenylethyl)-N-([3-(trifluoromethyl)phenyl])-N-phenylpiperidin-4-amine
SpectraBase Compound ID EuOXcsj9JKE
InChI InChI=1S/C27H29F3N2/c28-27(29,30)24-11-7-10-23(20-24)21-32(25-12-5-2-6-13-25)26-15-18-31(19-16-26)17-14-22-8-3-1-4-9-22/h1-13,20,26H,14-19,21H2
InChIKey BPWGJGQJUDRZMD-UHFFFAOYSA-N
Mol Weight 438.54 g/mol
Molecular Formula C27H29F3N2
Exact Mass 438.228283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F4B6swu1yol
Name 1-(2-Phenylethyl)-N-([3-(trifluoromethyl)phenyl])-N-phenylpiperidin-4-amine
Comments Computed using HOSE algorithm
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Exact Mass 438.228283431 u
Formula C27H29F3N2
InChI InChI=1S/C27H29F3N2/c28-27(29,30)24-11-7-10-23(20-24)21-32(25-12-5-2-6-13-25)26-15-18-31(19-16-26)17-14-22-8-3-1-4-9-22/h1-13,20,26H,14-19,21H2
InChIKey BPWGJGQJUDRZMD-UHFFFAOYSA-N
Molecular Weight 438.538 g/mol
SMILES C1(N(C2=CC=CC=C2)CC2=CC(C(F)(F)F)=CC=C2)CCN(CC1)CCC1=CC=CC=C1