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9H-purine-2,6-diamine, N~6~-[4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID I6y8H344jSI
InChI InChI=1S/C12H9F3N6/c13-12(14,15)6-1-3-7(4-2-6)19-10-8-9(18-5-17-8)20-11(16)21-10/h1-5H,(H4,16,17,18,19,20,21)
InChIKey ILPPTDIOLUHNGA-UHFFFAOYSA-N
Mol Weight 294.24 g/mol
Molecular Formula C12H9F3N6
Exact Mass 294.084079 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4ToGulXF6vf
Name 9H-purine-2,6-diamine, N~6~-[4-(trifluoromethyl)phenyl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H9F3N6/c13-12(14,15)6-1-3-7(4-2-6)19-10-8-9(18-5-17-8)20-11(16)21-10/h1-5H,(H4,16,17,18,19,20,21)
InChIKey ILPPTDIOLUHNGA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3855
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: F18739; Labnumber: ExLab-203217