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2,3'-Dichloro-4-nitrocarbanilide
SpectraBase Compound ID HHvk6RNauH3
InChI InChI=1S/C13H9Cl2N3O3/c14-8-2-1-3-9(6-8)16-13(19)17-12-5-4-10(18(20)21)7-11(12)15/h1-7H,(H2,16,17,19)
InChIKey IKKNWNPYWGXRGL-UHFFFAOYSA-N
Mol Weight 326.14 g/mol
Molecular Formula C13H9Cl2N3O3
Exact Mass 325.002097 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BMrruj26ONk
Name 2,3'-Dichloro-4-nitrocarbanilide
Comments Computed using HOSE algorithm
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Exact Mass 325.002096559 u
Formula C13H9Cl2N3O3
InChI InChI=1S/C13H9Cl2N3O3/c14-8-2-1-3-9(6-8)16-13(19)17-12-5-4-10(18(20)21)7-11(12)15/h1-7H,(H2,16,17,19)
InChIKey IKKNWNPYWGXRGL-UHFFFAOYSA-N
Molecular Weight 326.139 g/mol
SMILES N(C=1C=C(C=CC1)Cl)C(NC1=C(C=C(C=C1)N(=O)=O)Cl)=O