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1,3,5-triazine-2,4-diamine, N~2~-(4-methoxyphenyl)-6-(1-piperidinyl)-N~4~-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 3HTs1ZsA5S5
InChI InChI=1S/C22H23F3N6O/c1-32-18-10-8-16(9-11-18)26-19-28-20(30-21(29-19)31-12-3-2-4-13-31)27-17-7-5-6-15(14-17)22(23,24)25/h5-11,14H,2-4,12-13H2,1H3,(H2,26,27,28,29,30)
InChIKey OFAOSDOSGWXHHF-UHFFFAOYSA-N
Mol Weight 444.46 g/mol
Molecular Formula C22H23F3N6O
Exact Mass 444.188544 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 24WRCl5ex7x
Name 1,3,5-triazine-2,4-diamine, N~2~-(4-methoxyphenyl)-6-(1-piperidinyl)-N~4~-[3-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.188543873 u
Formula C22H23F3N6O
InChI InChI=1S/C22H23F3N6O/c1-32-18-10-8-16(9-11-18)26-19-28-20(30-21(29-19)31-12-3-2-4-13-31)27-17-7-5-6-15(14-17)22(23,24)25/h5-11,14H,2-4,12-13H2,1H3,(H2,26,27,28,29,30)
InChIKey OFAOSDOSGWXHHF-UHFFFAOYSA-N
Molecular Weight 444.462 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14445
Solvent DMSO-d6
Source Vendor ID: NMR/10260672; Lab Info: L-31; Lab Number: L31-0000032