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2'-[(hexahydro-2-oxo-1H-azepin-3-yl)carbamoyl]-2,2,2-trichloroacetanilide
SpectraBase Compound ID AaBKrrehlZH
InChI InChI=1S/C15H16Cl3N3O3/c16-15(17,18)14(24)21-10-6-2-1-5-9(10)12(22)20-11-7-3-4-8-19-13(11)23/h1-2,5-6,11H,3-4,7-8H2,(H,19,23)(H,20,22)(H,21,24)
InChIKey QTPYLAFBGJUPRF-UHFFFAOYSA-N
Mol Weight 392.67 g/mol
Molecular Formula C15H16Cl3N3O3
Exact Mass 391.025724 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4C2etABEgCn
Name 2'-[(hexahydro-2-oxo-1H-azepin-3-yl)carbamoyl]-2,2,2-trichloroacetanilide
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Formula C15H16Cl3N3O3
InChI InChI=1S/C15H16Cl3N3O3/c16-15(17,18)14(24)21-10-6-2-1-5-9(10)12(22)20-11-7-3-4-8-19-13(11)23/h1-2,5-6,11H,3-4,7-8H2,(H,19,23)(H,20,22)(H,21,24)
InChIKey QTPYLAFBGJUPRF-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 56270M
Solvent CDCl3