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3,6-DIMETHYL-4-PHENYL-ISOXAZOLO-[3,4-D]-PYRIDAZIN-7-(6H)-ONE
SpectraBase Compound ID HcaEi22wPkX
InChI InChI=1S/C13H11N3O2/c1-8-10-11(9-6-4-3-5-7-9)14-16(2)13(17)12(10)15-18-8/h3-7H,1-2H3
InChIKey XJXJGEAQOLTDAY-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C13H11N3O2
Exact Mass 241.085127 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A4F0hX9Oa25
Name 3,6-DIMETHYL-4-PHENYL-ISOXAZOLO-[3,4-D]-PYRIDAZIN-7-(6H)-ONE
Compound Number 1I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11N3O2
InChI InChI=1S/C13H11N3O2/c1-8-10-11(9-6-4-3-5-7-9)14-16(2)13(17)12(10)15-18-8/h3-7H,1-2H3
InChIKey XJXJGEAQOLTDAY-UHFFFAOYSA-N
Literature Reference Author V.D.PIAZ,A.GRAZIANO,N.HAIDER,W.HOLZER
Literature Reference Citation MAGN.RES.CHEM.,43,240(2005)
Literature Reference DOI 10.1002/mrc.1528
Solvent DMSO-D6
Source File Reference UWSI27049