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N-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]-4-[4-(3-chlorophenyl)piperazin-1-yl]-6-methoxy-1,3,5-triazin-2-amine
SpectraBase Compound ID 5lnEIQ4y8JZ
InChI InChI=1S/C21H20Cl2F2N6O2/c1-32-20-28-18(26-15-5-7-17(8-6-15)33-21(23,24)25)27-19(29-20)31-11-9-30(10-12-31)16-4-2-3-14(22)13-16/h2-8,13H,9-12H2,1H3,(H,26,27,28,29)
InChIKey NAJOKRWQXNFCKR-UHFFFAOYSA-N
Mol Weight 497.33 g/mol
Molecular Formula C21H20Cl2F2N6O2
Exact Mass 496.099286 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ai0kjjRxpoL
Name 1,3,5-triazin-2-amine, N-[4-(chlorodifluoromethoxy)phenyl]-4-[4-(3-chlorophenyl)-1-piperazinyl]-6-methoxy-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 496.099285632 u
Formula C21H20Cl2F2N6O2
InChI InChI=1S/C21H20Cl2F2N6O2/c1-32-20-28-18(26-15-5-7-17(8-6-15)33-21(23,24)25)27-19(29-20)31-11-9-30(10-12-31)16-4-2-3-14(22)13-16/h2-8,13H,9-12H2,1H3,(H,26,27,28,29)
InChIKey NAJOKRWQXNFCKR-UHFFFAOYSA-N
Molecular Weight 497.334 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14563
Solvent DMSO-d6
Source Vendor ID: NMR/10320134; Lab Info: AS; Lab Number: AS-X000046