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1-(3,3-DIPHENYL-4-OXO-4-(1-PYRROLIDINYL)BUTYL]-4-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-4-PIPERIDINOL, MONOHYDROCHLORIDE, DIHYDRATE
SpectraBase Compound ID EqXgWHD03Wn
InChI InChI=1S/C32H35F3N2O2.ClH.2H2O/c33-32(34,35)28-15-9-14-27(24-28)30(39)16-21-36(22-17-30)23-18-31(25-10-3-1-4-11-25,26-12-5-2-6-13-26)29(38)37-19-7-8-20-37;;;/h1-6,9-15,24,39H,7-8,16-23H2;1H;2*1H2
InChIKey CJPRHACKIDRXBM-UHFFFAOYSA-N
Mol Weight 609.13 g/mol
Molecular Formula C32H40ClF3N2O4
Exact Mass 608.26287 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JlIRQR8xKvG
Name 1-[3,3-diphenyl-4-oxo-4-(1-pyrrolidinyl)butyl]-4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4-piperidinol, monohydrochloride, dihydrate
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Formula C32H40ClF3N2O4
InChI InChI=1S/C32H35F3N2O2.ClH.2H2O/c33-32(34,35)28-15-9-14-27(24-28)30(39)16-21-36(22-17-30)23-18-31(25-10-3-1-4-11-25,26-12-5-2-6-13-26)29(38)37-19-7-8-20-37;;;/h1-6,9-15,24,39H,7-8,16-23H2;1H;2*1H2
InChIKey CJPRHACKIDRXBM-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 53956M
Solvent CDCl3