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1,3,5-triazine-2,4-diamine, N~2~-[4-(chlorodifluoromethoxy)phenyl]-N~4~-propyl-6-(4-tricyclo[3.3.1.1~3,7~]dec-1-yl-1-piperazinyl)-

View entire compound with spectra: 1 NMR

1,3,5-triazine-2,4-diamine, N~2~-[4-(chlorodifluoromethoxy)phenyl]-N~4~-propyl-6-(4-tricyclo[3.3.1.1~3,7~]dec-1-yl-1-piperazinyl)-
SpectraBase Compound ID DR94kR2JrNe
InChI InChI=1S/C27H36ClF2N7O/c1-2-7-31-23-33-24(32-21-3-5-22(6-4-21)38-27(28,29)30)35-25(34-23)36-8-10-37(11-9-36)26-15-18-12-19(16-26)14-20(13-18)17-26/h3-6,18-20H,2,7-17H2,1H3,(H2,31,32,33,34,35)/t18-,19+,20-,26-
InChIKey MXSRWHPYZKTAKP-VTTXJZCFSA-N
Mol Weight 548.1 g/mol
Molecular Formula C27H36ClF2N7O
Exact Mass 547.263793 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BFLFOj8F2Me
Name 1,3,5-triazine-2,4-diamine, N~2~-[4-(chlorodifluoromethoxy)phenyl]-N~4~-propyl-6-(4-tricyclo[3.3.1.1~3,7~]dec-1-yl-1-piperazinyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 547.263792832 u
Formula C27H36ClF2N7O
InChI InChI=1S/C27H36ClF2N7O/c1-2-7-31-23-33-24(32-21-3-5-22(6-4-21)38-27(28,29)30)35-25(34-23)36-8-10-37(11-9-36)26-15-18-12-19(16-26)14-20(13-18)17-26/h3-6,18-20H,2,7-17H2,1H3,(H2,31,32,33,34,35)/t18-,19+,20-,26-
InChIKey MXSRWHPYZKTAKP-VTTXJZCFSA-N
Molecular Weight 548.083 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17989
Solvent DMSO-d6
Source Vendor ID: NMR/11260424; Lab Info: AS; Lab Number: AS-X000094