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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32BXVDooXPi
Name 5-(3-azido-4-chloranyl-phenyl)-6-ethyl-pyrimidine-2,4-diamine
Alternate Name(s) 5-(3-azido-4-chloro-phenyl)-6-ethyl-pyrimidine-2,4-diamine [2-amino-5-(3-azido-4-chloro-phenyl)-6-ethyl-pyrimidin-4-yl]amine
CAS Registry Number 95458-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Molecular Weight 289.730 g/mol
SMILES Nc1nc(c(c(n1)CC)-c1cc(N=[N+]=[N-])c(cc1)Cl)N
SPLASH splash10-02vi-4090000000-53ce0ba2cef08574fadc
Source of Spectrum KC-1987-2225-36
Wiley ID 1292431