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3-(PARA-CHLOROPHENYL)-2,5-DIMETHYLTETRAHYDROPYRROLO-[3,4-D]-ISOXAZOL-4,6-DIONE
SpectraBase Compound ID JdBnNkjWxP5
InChI InChI=1S/2C13H13ClN2O3/c2*1-15-12(17)9-10(7-3-5-8(14)6-4-7)16(2)19-11(9)13(15)18/h2*3-6,9-11H,1-2H3/t2*9-,10-,11+/m10/s1
InChIKey XNNYPXXOJYFENE-WYDXRQDBSA-N
Mol Weight 561.42 g/mol
Molecular Formula C26H26Cl2N4O6
Exact Mass 560.12294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GUZLiv5sDoL
Name 3-(PARA-CHLOROPHENYL)-2,5-DIMETHYLTETRAHYDROPYRROLO-[3,4-D]-ISOXAZOL-4,6-DIONE
Compound Number 3G-TRANS
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H26Cl2N4O6
InChI InChI=1S/2C13H13ClN2O3/c2*1-15-12(17)9-10(7-3-5-8(14)6-4-7)16(2)19-11(9)13(15)18/h2*3-6,9-11H,1-2H3/t2*9-,10-,11+/m10/s1
InChIKey XNNYPXXOJYFENE-WYDXRQDBSA-N
Literature Reference Author K.PIHLAJA,P.TAEHTINEN,R.SHAKHUTDINOV,H.HARTIKAINEN,V.OVCHARE NKO,H.AGIRBAS,S.GUEN
Literature Reference Citation J.HETCYCL.CHEM.,41,741(2004)
Literature Reference DOI 10.1002/jhet.5570410515
Molecular Weight 561.422 g/mol
Solvent CDCl3
Source File Reference UWLU22484