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1H-pyrazolo[3,4-d]pyrimidin-4-amine, 1-(4-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 1iJkWUUoGm5
InChI InChI=1S/C18H11ClF3N5/c19-12-4-6-14(7-5-12)27-17-15(9-25-27)16(23-10-24-17)26-13-3-1-2-11(8-13)18(20,21)22/h1-10H,(H,23,24,26)
InChIKey ZNXRUEGGFHYSDH-UHFFFAOYSA-N
Mol Weight 389.77 g/mol
Molecular Formula C18H11ClF3N5
Exact Mass 389.065508 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HagC8bQkLVz
Name 1H-pyrazolo[3,4-d]pyrimidin-4-amine, 1-(4-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H11ClF3N5/c19-12-4-6-14(7-5-12)27-17-15(9-25-27)16(23-10-24-17)26-13-3-1-2-11(8-13)18(20,21)22/h1-10H,(H,23,24,26)
InChIKey ZNXRUEGGFHYSDH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6620
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/10278621