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Dimethyl 1,2,6,7-tetrahydro-6-methyl-5-oxo-2-phenyl-1,2-diazepine-3,4-dicarboxylate
SpectraBase Compound ID 2x5zma1qmQk
InChI InChI=1S/C16H18N2O5/c1-10-9-17-18(11-7-5-4-6-8-11)13(16(21)23-3)12(14(10)19)15(20)22-2/h4-8,10,17H,9H2,1-3H3
InChIKey FLXVUSCWBFFFAG-UHFFFAOYSA-N
Mol Weight 318.33 g/mol
Molecular Formula C16H18N2O5
Exact Mass 318.121572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3aMv6aS6uqF
Name Dimethyl 1,2,6,7-tetrahydro-6-methyl-5-oxo-2-phenyl-1,2-diazepine-3,4-dicarboxylate
CAS Registry Number 53709-69-6
Comments STRUCTURE CHANGED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H18N2O5
InChI InChI=1S/C16H18N2O5/c1-10-9-17-18(11-7-5-4-6-8-11)13(16(21)23-3)12(14(10)19)15(20)22-2/h4-8,10,17H,9H2,1-3H3
InChIKey FLXVUSCWBFFFAG-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference S.N. Ege, M.L. Carter, R.L. Spencer, J. Chem. Soc. Perkin I 868 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3