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2,5-DIMETHYL-3-(PARA-NITROPHENYL)-TETRAHYDROPYRROLO-[3,4-D]-ISOXAZOL-4,6-DIONE
SpectraBase Compound ID AELuisJB6Nd
InChI InChI=1S/C13H13N3O5/c1-14-12(17)9-10(15(2)21-11(9)13(14)18)7-3-5-8(6-4-7)16(19)20/h3-6,9-11H,1-2H3/t9-,10+,11+/m1/s1
InChIKey BEXSPPFYRXKOEF-VWYCJHECSA-N
Mol Weight 291.26 g/mol
Molecular Formula C13H13N3O5
Exact Mass 291.085521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7SHzNgloVNG
Name 2,5-DIMETHYL-3-(PARA-NITROPHENYL)-TETRAHYDROPYRROLO-[3,4-D]-ISOXAZOL-4,6-DIONE
Compound Number 3H-CIS
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13N3O5
InChI InChI=1S/C13H13N3O5/c1-14-12(17)9-10(15(2)21-11(9)13(14)18)7-3-5-8(6-4-7)16(19)20/h3-6,9-11H,1-2H3/t9-,10+,11+/m1/s1
InChIKey BEXSPPFYRXKOEF-VWYCJHECSA-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 291.263 g/mol
Solvent CDCl3
Source File Reference UWLU22485