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ethanediamide, N~1~-[2-(4-chlorophenyl)ethyl]-N~2~-(2,3-dichlorophenyl)-
SpectraBase Compound ID J7miopgoea2
InChI InChI=1S/C16H13Cl3N2O2/c17-11-6-4-10(5-7-11)8-9-20-15(22)16(23)21-13-3-1-2-12(18)14(13)19/h1-7H,8-9H2,(H,20,22)(H,21,23)
InChIKey DREKRICCEICIMI-UHFFFAOYSA-N
Mol Weight 371.65 g/mol
Molecular Formula C16H13Cl3N2O2
Exact Mass 370.004261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ssGIa3x6vK
Name Ethanediamide, N~1~-[2-(4-chlorophenyl)ethyl]-N~2~-(2,3-dichlorophenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 370.004260765 u
Formula C16H13Cl3N2O2
InChI InChI=1S/C16H13Cl3N2O2/c17-11-6-4-10(5-7-11)8-9-20-15(22)16(23)21-13-3-1-2-12(18)14(13)19/h1-7H,8-9H2,(H,20,22)(H,21,23)
InChIKey DREKRICCEICIMI-UHFFFAOYSA-N
Molecular Weight 371.651 g/mol
SMILES N(C(C(=O)NCCC1=CC=C(C=C1)Cl)=O)C=1C(=C(Cl)C=CC1)Cl