John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DWS1GcHMSoG SpectraBase Spectrum ID=1k7DjgNiIf9

(accessed ).
1-[1-(3-BENZOYLPROPYL)-4-PIPERIDYL]-3-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)UREA, MONOHYDROCHLORIDE, MONOHYDRATE
SpectraBase Compound ID DWS1GcHMSoG
InChI InChI=1S/C23H26F3N3O2.ClH.H2O/c24-23(25,26)18-8-4-9-20(16-18)28-22(31)27-19-11-14-29(15-12-19)13-5-10-21(30)17-6-2-1-3-7-17;;/h1-4,6-9,16,19H,5,10-15H2,(H2,27,28,31);1H;1H2
InChIKey XXWSSSZERBSNOH-UHFFFAOYSA-N
Mol Weight 487.95 g/mol
Molecular Formula C23H29ClF3N3O3
Exact Mass 487.184954 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1k7DjgNiIf9
Name 1-[1-(3-benzoylpropyl)-4-piperidyl]-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea, monohydrochloride, monohydrate
Copyright Copyright © 2009-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29ClF3N3O3
InChI InChI=1S/C23H26F3N3O2.ClH.H2O/c24-23(25,26)18-8-4-9-20(16-18)28-22(31)27-19-11-14-29(15-12-19)13-5-10-21(30)17-6-2-1-3-7-17;;/h1-4,6-9,16,19H,5,10-15H2,(H2,27,28,31);1H;1H2
InChIKey XXWSSSZERBSNOH-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 36657M
Solvent Polysol
SpectraBase Batch ID BTHtN4DXkDa