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2,2'-(Propylimino)bis[4,4',6,6'-tetrachloropyrimidine]
SpectraBase Compound ID FTfsmhw5roE
InChI InChI=1S/C11H9Cl4N5/c1-2-3-20(10-16-6(12)4-7(13)17-10)11-18-8(14)5-9(15)19-11/h4-5H,2-3H2,1H3
InChIKey WIBDMGOAEZKIHQ-UHFFFAOYSA-N
Mol Weight 353.0 g/mol
Molecular Formula C11H9Cl4N5
Exact Mass 350.961206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8SCz3AzFtQ2
Name 2,2'-(Propylimino)bis[4,4',6,6'-tetrachloropyrimidine]
Comments Computed using HOSE algorithm
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Exact Mass 350.961206110 u
Formula C11H9Cl4N5
InChI InChI=1S/C11H9Cl4N5/c1-2-3-20(10-16-6(12)4-7(13)17-10)11-18-8(14)5-9(15)19-11/h4-5H,2-3H2,1H3
InChIKey WIBDMGOAEZKIHQ-UHFFFAOYSA-N
Molecular Weight 353.040 g/mol
SMILES C1=C(N=C(N=C1Cl)N(C=1N=C(C=C(N1)Cl)Cl)CCC)Cl