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N,N'-bis(2-chloroethyl)dicarbonimidic diamide
SpectraBase Compound ID 30oIcJ40Iav
InChI InChI=1S/C6H11Cl2N3O2/c7-1-3-9-5(12)11-6(13)10-4-2-8/h1-4H2,(H3,9,10,11,12,13)
InChIKey YEAPZDVWWPEUCZ-UHFFFAOYSA-N
Mol Weight 228.08 g/mol
Molecular Formula C6H11Cl2N3O2
Exact Mass 227.022832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9tFDDT2dYp
Name N,N'-bis(2-Chloroethyl)dicarbonimidic diamide
Comments Computed using HOSE algorithm
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Exact Mass 227.022832004 u
Formula C6H11Cl2N3O2
InChI InChI=1S/C6H11Cl2N3O2/c7-1-3-9-5(12)11-6(13)10-4-2-8/h1-4H2,(H3,9,10,11,12,13)
InChIKey YEAPZDVWWPEUCZ-UHFFFAOYSA-N
Molecular Weight 228.079 g/mol
SMILES N(C(NC(=O)NCCCl)=O)CCCl