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(5S,6R)-1-(benzyl)-3,7-diketo-1,4-diazepane-5,6-dicarboxylic acid dimethyl ester

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(5S,6R)-1-(benzyl)-3,7-diketo-1,4-diazepane-5,6-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 1751sbWEpuR
InChI InChI=1S/C16H18N2O6/c1-23-15(21)12-13(16(22)24-2)17-11(19)9-18(14(12)20)8-10-6-4-3-5-7-10/h3-7,12-13H,8-9H2,1-2H3,(H,17,19)/t12-,13+/m1/s1
InChIKey RGYGARUUXTUIEW-OLZOCXBDSA-N
Mol Weight 334.33 g/mol
Molecular Formula C16H18N2O6
Exact Mass 334.116486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4eXStx4RvMO
Name (5S,6R)-1-(benzyl)-3,7-diketo-1,4-diazepane-5,6-dicarboxylic acid dimethyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18N2O6
InChI InChI=1S/C16H18N2O6/c1-23-15(21)12-13(16(22)24-2)17-11(19)9-18(14(12)20)8-10-6-4-3-5-7-10/h3-7,12-13H,8-9H2,1-2H3,(H,17,19)/t12-,13+/m1/s1
InChIKey RGYGARUUXTUIEW-OLZOCXBDSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 334.329 g/mol
Source File Reference MHKO9190