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3-[2-(2,4-Dichlorophenyl)ethenyl]-4,5,6,7-tetrahydroisoxazolo[4,3-c]pyridin-4-one
SpectraBase Compound ID BfYb2lkfFSs
InChI InChI=1S/C14H10Cl2N2O2/c15-9-3-1-8(10(16)7-9)2-4-12-13-11(18-20-12)5-6-17-14(13)19/h1-4,7H,5-6H2,(H,17,19)/b4-2+
InChIKey UELBKXPDBFXRKY-DUXPYHPUSA-N
Mol Weight 309.15 g/mol
Molecular Formula C14H10Cl2N2O2
Exact Mass 308.011933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G07kXH9Go8m
Name 3-[2-(2,4-DICHLOROPHENYL)-ETHENYL]-4,5,6,7-TETRAHYDRO-ISOXAZOLO-[4,3-C]-PYRIDIN-4-ONE
Compound Number 8D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H10Cl2N2O2
InChI InChI=1S/C14H10Cl2N2O2/c15-9-3-1-8(10(16)7-9)2-4-12-13-11(18-20-12)5-6-17-14(13)19/h1-4,7H,5-6H2,(H,17,19)/b4-2+
InChIKey UELBKXPDBFXRKY-DUXPYHPUSA-N
Literature Reference Author R.C.F.JONES,A.K.CHOUDHURY,J.N.ILEY,M.E.LIGHT,G.LOIZOU,T.A.PI LLAINAYAGAM
Literature Reference Citation BEIL.J.ORG.CHEM.,8,308(2012)
Literature Reference DOI 10.3762/bjoc.8.33
Molecular Weight 309.152 g/mol
Solvent DMSO-D6
Source File Reference UWIR10134