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Dimethyl 1-cyclohexylamino-4,5,6,7-tetrahydro-7-methyl-4-oxo-1H-azepine-2,3-dicarboxylate
SpectraBase Compound ID DUGyc0Fkv8M
InChI InChI=1S/C17H26N2O5/c1-11-9-10-13(20)14(16(21)23-2)15(17(22)24-3)19(11)18-12-7-5-4-6-8-12/h11-12,18H,4-10H2,1-3H3
InChIKey ANDDTGCZIDDFSW-UHFFFAOYSA-N
Mol Weight 338.4 g/mol
Molecular Formula C17H26N2O5
Exact Mass 338.184172 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ka5VrDa82WE
Name Dimethyl 1-cyclohexylamino-4,5,6,7-tetrahydro-7-methyl-4-oxo-1H-azepine-2,3-dicarboxylate
CAS Registry Number 64233-12-1
Comments reassigned
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Formula C17H26N2O5
InChI InChI=1S/C17H26N2O5/c1-11-9-10-13(20)14(16(21)23-2)15(17(22)24-3)19(11)18-12-7-5-4-6-8-12/h11-12,18H,4-10H2,1-3H3
InChIKey ANDDTGCZIDDFSW-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference S.N. Ege, M.C. Carter, D.F. Ortwine, J. Chem. Soc. Perkin I 1252 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3