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5-ETHYL-5-(3-NITROPHTHALIMIDO)-1-PHENYLBARBITURIC-ACID
SpectraBase Compound ID 5sYIvhGk0Rd
InChI InChI=1S/C20H14N4O7/c1-2-20(17(27)21-19(29)22(18(20)28)11-7-4-3-5-8-11)23-15(25)12-9-6-10-13(24(30)31)14(12)16(23)26/h3-10H,2H2,1H3,(H,21,27,29)
InChIKey YJIQNVAVKABWSL-UHFFFAOYSA-N
Mol Weight 422.35 g/mol
Molecular Formula C20H14N4O7
Exact Mass 422.086249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BV33NpjoCRf
Name 5-ETHYL-5-(3-NITROPHTHALIMIDO)-1-PHENYLBARBITURIC-ACID
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H14N4O7
InChI InChI=1S/C20H14N4O7/c1-2-20(17(27)21-19(29)22(18(20)28)11-7-4-3-5-8-11)23-15(25)12-9-6-10-13(24(30)31)14(12)16(23)26/h3-10H,2H2,1H3,(H,21,27,29)
InChIKey YJIQNVAVKABWSL-UHFFFAOYSA-N
Literature Reference Author M.GUETSCHOW,T.HECKER,A.THIELE,S.HAUSCHILDT,K.EGER
Literature Reference Citation BIOORG.MED.CHEM.,9,1059(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00323-0
Molecular Weight 422.354 g/mol
Solvent DMSO-D6
Source File Reference UWLU21949