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3-ETHOXYCARBONYLMETHYL-2,3-DIHYDRO-1H-1,4-BENZODIAZEPIN-2-ONE-N-OXIDE
SpectraBase Compound ID 3z4A6pPWjft
InChI InChI=1S/C13H14N2O4/c1-2-19-12(16)7-11-13(17)14-10-6-4-3-5-9(10)8-15(11)18/h3-6,8,11H,2,7H2,1H3,(H,14,17)
InChIKey CKZLCIGLXNAHOW-UHFFFAOYSA-N
Mol Weight 262.26 g/mol
Molecular Formula C13H14N2O4
Exact Mass 262.095357 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IfwGNOCBMfe
Name 3-ETHOXYCARBONYLMETHYL-2,3-DIHYDRO-1H-1,4-BENZODIAZEPIN-2-ONE-N-OXIDE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N2O4
InChI InChI=1S/C13H14N2O4/c1-2-19-12(16)7-11-13(17)14-10-6-4-3-5-9(10)8-15(11)18/h3-6,8,11H,2,7H2,1H3,(H,14,17)
InChIKey CKZLCIGLXNAHOW-UHFFFAOYSA-N
Literature Reference Author F.HEANEY,S.BOURKE,D.CUNNINGHAM,P.MCARDLE
Literature Reference Citation J.CHEM.SOC.PERKIN-2,547(1998)
Literature Reference DOI 10.1039/a707857i
Molecular Weight 262.265 g/mol
Solvent CDCl3
Source File Reference UWRU12110