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2,4-Diamino-5-(3-azido-4-chloro-phenyl)-6-ethyl-pyrimidine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2,4-Diamino-5-(3-azido-4-chloro-phenyl)-6-ethyl-pyrimidine
SpectraBase Compound ID AK2Uu0beUYV
InChI InChI=1S/C12H12ClN7/c1-2-8-10(11(14)18-12(15)17-8)6-3-4-7(13)9(5-6)19-20-16/h3-5H,2H2,1H3,(H4,14,15,17,18)
InChIKey CTABHCUZJBWUKN-UHFFFAOYSA-N
Mol Weight 289.73 g/mol
Molecular Formula C12H12ClN7
Exact Mass 289.084271 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ekc8jE4ZssG
Name 2,4-Diamino-5-(3-azido-4-chloro-phenyl)-6-ethyl-pyrimidine
CAS Registry Number 95458-40-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H12ClN7
InChI InChI=1S/C12H12ClN7/c1-2-8-10(11(14)18-12(15)17-8)6-3-4-7(13)9(5-6)19-20-16/h3-5H,2H2,1H3,(H4,14,15,17,18)
InChIKey CTABHCUZJBWUKN-UHFFFAOYSA-N
Instrument Name Bruker WH-400
Literature Reference M.D. Threadgill, R.J. Griffin, J. Chem. Soc. Perkin I 2229 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6