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2-METHYL-3-(1,2-O-ISOPROPYLIDENE-3-ACETOXY-ALPHA-D-XYLO-TETRAFURANOS-4-YL)-5-(4-FLUOROPHENYL)-4,6-DIOXO-2,3,3A,4,6,6A-HEXAHYDROPYRROLO-[3,4-D]-ISOXAZOLE;COMPOU
SpectraBase Compound ID 6TUKxqrLD9a
InChI InChI=1S/C21H23FN2O8/c1-9(25)28-16-15(29-20-17(16)30-21(2,3)31-20)13-12-14(32-23(13)4)19(27)24(18(12)26)11-7-5-10(22)6-8-11/h5-8,12-17,20H,1-4H3/t12-,13-,14+,15+,16-,17+,20+/m0/s1
InChIKey NZYIVDKAMMBHFK-SNCRXCSTSA-N
Mol Weight 450.42 g/mol
Molecular Formula C21H23FN2O8
Exact Mass 450.143844 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PAnRpkz4j0
Name 2-METHYL-3-(1,2-O-ISOPROPYLIDENE-3-ACETOXY-ALPHA-D-XYLO-TETRAFURANOS-4-YL)-5-(4-FLUOROPHENYL)-4,6-DIOXO-2,3,3A,4,6,6A-HEXAHYDROPYRROLO-[3,4-D]-ISOXAZOLE;COMPOU
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23FN2O8
InChI InChI=1S/C21H23FN2O8/c1-9(25)28-16-15(29-20-17(16)30-21(2,3)31-20)13-12-14(32-23(13)4)19(27)24(18(12)26)11-7-5-10(22)6-8-11/h5-8,12-17,20H,1-4H3/t12-,13-,14+,15+,16-,17+,20+/m0/s1
InChIKey NZYIVDKAMMBHFK-SNCRXCSTSA-N
Literature Reference Author U.A.R.AL-TIMARI,L.FISERA,P.ERTL,I.GOLJER,N.PRONAYOVA
Literature Reference Citation MH.CHEM.,123,999(1992)
Literature Reference DOI 10.1007/BF00810931
Molecular Weight 450.421 g/mol
Solvent CDCl3
Source File Reference UWSK1046