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2,5,6-Trimethyl-N-(3-chloro-4-tolyl)-7H-pyrrolo(2,3-D)pyrimidin-4-amine
SpectraBase Compound ID KtlGGS6ZZiC
InChI InChI=1S/C16H17ClN4/c1-8-5-6-12(7-13(8)17)21-16-14-9(2)10(3)18-15(14)19-11(4)20-16/h5-7H,1-4H3,(H2,18,19,20,21)
InChIKey RNKRFVHUDDXODA-UHFFFAOYSA-N
Mol Weight 300.79 g/mol
Molecular Formula C16H17ClN4
Exact Mass 300.114174 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ND3wK4x7d5
Name 2,5,6-Trimethyl-N-(3-chloro-4-tolyl)-7H-pyrrolo(2,3-D)pyrimidin-4-amine
CAS Registry Number 104915-49-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H17ClN4
InChI InChI=1S/C16H17ClN4/c1-8-5-6-12(7-13(8)17)21-16-14-9(2)10(3)18-15(14)19-11(4)20-16/h5-7H,1-4H3,(H2,18,19,20,21)
InChIKey RNKRFVHUDDXODA-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference A. Jorgensen, K.A. El-Bayouki, E.B. Pedersen, Chemica Scripta 25, 222 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6