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5-(4,6)dichloropyrimidin-5-yl)-6-nitrobenzimidazole
SpectraBase Compound ID G84JL7qGFyE
InChI InChI=1S/C11H5Cl2N5O2/c12-10-9(11(13)17-4-16-10)5-1-6-7(15-3-14-6)2-8(5)18(19)20/h1-4H,(H,14,15)
InChIKey BJITVJLJBJGLHD-UHFFFAOYSA-N
Mol Weight 310.1 g/mol
Molecular Formula C11H5Cl2N5O2
Exact Mass 308.98203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8WcP7iiKgtx
Name 5-(4,6)dichloropyrimidin-5-yl)-6-nitrobenzimidazole
Alternate Name(s) 5-(4,6-dichloro-5-pyrimidinyl)-6-nitro-1H-benzimidazole
CAS Registry Number 96228-72-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H5Cl2N5O2
InChI InChI=1S/C11H5Cl2N5O2/c12-10-9(11(13)17-4-16-10)5-1-6-7(15-3-14-6)2-8(5)18(19)20/h1-4H,(H,14,15)
InChIKey BJITVJLJBJGLHD-UHFFFAOYSA-N
Molecular Weight 310.100 g/mol
SMILES [nH]1cnc2c1cc(c(c2)-c1c(ncnc1Cl)Cl)N(=O)=O
SPLASH splash10-00di-0090000000-87540d908a5c6a60b82f
Source of Spectrum J-50-2461-25
Wiley ID 1310442