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2,2-dimethyl-5-[[[5-(4-nitrophenyl)-1H-pyrazol-3-yl]amino]methylene]-1,3-dioxane-4,6-quinone
SpectraBase Compound ID KVKESQcZvKK
InChI InChI=1S/C16H14N4O6/c1-16(2)25-14(21)11(15(22)26-16)8-17-13-7-12(18-19-13)9-3-5-10(6-4-9)20(23)24/h3-8H,1-2H3,(H2,17,18,19)
InChIKey LAZVKLGWYPKPGM-UHFFFAOYSA-N
Mol Weight 358.31 g/mol
Molecular Formula C16H14N4O6
Exact Mass 358.091334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1elFhNr7GfC
Name 2,2-dimethyl-5-[[[5-(4-nitrophenyl)-1H-pyrazol-3-yl]amino]methylene]-1,3-dioxane-4,6-quinone
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14N4O6
InChI InChI=1S/C16H14N4O6/c1-16(2)25-14(21)11(15(22)26-16)8-17-13-7-12(18-19-13)9-3-5-10(6-4-9)20(23)24/h3-8H,1-2H3,(H2,17,18,19)
InChIKey LAZVKLGWYPKPGM-UHFFFAOYSA-N
Literature Reference Author J.QUIROGA,A.HORMAZA,B.INSUASTY,C.SAITZ,C.JULLIAN,A.CANETE
Literature Reference Citation J.HETCYCL.CHEM.,35,61(1998)
Literature Reference DOI 10.1002/jhet.5570350112
Molecular Weight 358.310 g/mol
Solvent DMSO-D6
Source File Reference UWCP8923