John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=F1FnsAWAUH7 SpectraBase Spectrum ID=Kpa70gctV9g

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1-(p-chlorophenyl)-3-(hexahydro-2-oxo-1H-azepin-3-yl)urea
SpectraBase Compound ID F1FnsAWAUH7
InChI InChI=1S/C13H16ClN3O2/c14-9-4-6-10(7-5-9)16-13(19)17-11-3-1-2-8-15-12(11)18/h4-7,11H,1-3,8H2,(H,15,18)(H2,16,17,19)
InChIKey KGIGQKCLQJAGTK-UHFFFAOYSA-N
Mol Weight 281.74 g/mol
Molecular Formula C13H16ClN3O2
Exact Mass 281.093105 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kpa70gctV9g
Name 1-(p-chlorophenyl)-3-(hexahydro-2-oxo-1H-azepin-3-yl)urea
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Formula C13H16ClN3O2
InChI InChI=1S/C13H16ClN3O2/c14-9-4-6-10(7-5-9)16-13(19)17-11-3-1-2-8-15-12(11)18/h4-7,11H,1-3,8H2,(H,15,18)(H2,16,17,19)
InChIKey KGIGQKCLQJAGTK-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 48672M
Solvent DMSO-d6
SpectraBase Batch ID Eyp4DdlPUhW