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2,2-bis(chloranyl)-N-(3,4-dichlorophenyl)ethanamide
SpectraBase Compound ID J2fqsOTmEYi
InChI InChI=1S/C8H5Cl4NO/c9-5-2-1-4(3-6(5)10)13-8(14)7(11)12/h1-3,7H,(H,13,14)
InChIKey KKFIMUBSUMZFNB-UHFFFAOYSA-N
Mol Weight 272.9 g/mol
Molecular Formula C8H5Cl4NO
Exact Mass 270.912525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Zbbt8LkOyT
Name 2,2-bis(Chloranyl)-N-(3,4-dichlorophenyl)ethanamide
Comments Computed using HOSE algorithm
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Exact Mass 270.912524584 u
Formula C8H5Cl4NO
InChI InChI=1S/C8H5Cl4NO/c9-5-2-1-4(3-6(5)10)13-8(14)7(11)12/h1-3,7H,(H,13,14)
InChIKey KKFIMUBSUMZFNB-UHFFFAOYSA-N
SMILES C(NC=1C=C(Cl)C(=CC1)Cl)(C(Cl)Cl)=O