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KQLMDOUSBKXGCA-UHFFFAOYSA-N
SpectraBase Compound ID Gu8tOv7DR35
InChI InChI=1S/C13H13N3O3/c1-8(17)16-13(19)10(12(14)15-16)7-11(18)9-5-3-2-4-6-9/h2-6,19H,7H2,1H3,(H2,14,15)
InChIKey KQLMDOUSBKXGCA-UHFFFAOYSA-N
Mol Weight 259.26 g/mol
Molecular Formula C13H13N3O3
Exact Mass 259.095691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FjOJYkemR8z
Name KQLMDOUSBKXGCA-UHFFFAOYSA-N
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13N3O3
InChI InChI=1S/C13H13N3O3/c1-8(17)16-13(19)10(12(14)15-16)7-11(18)9-5-3-2-4-6-9/h2-6,19H,7H2,1H3,(H2,14,15)
InChIKey KQLMDOUSBKXGCA-UHFFFAOYSA-N
Literature Reference Author M.T.COCCO,C.CONGIU,A.MACCIONI
Literature Reference Citation J.HETCYCL.CHEM.,27,683(1990)
Literature Reference DOI 10.1002/jhet.5570270337
Molecular Weight 259.265 g/mol
Solvent DMSO-D6
Source File Reference UWCP3051