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N-[(1S,7S,8S,8AR)-1-[(1'R)-1',2'-DIHYDROXYETHYL]-3,4,6,7,8,8A-HEXAHYDROXY-3,4-DIOXO-1H-PYRROLO-[1,2-D]-OXAZIN-8-YL]-ACETAMIDE

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N-[(1S,7S,8S,8AR)-1-[(1'R)-1',2'-DIHYDROXYETHYL]-3,4,6,7,8,8A-HEXAHYDROXY-3,4-DIOXO-1H-PYRROLO-[1,2-D]-OXAZIN-8-YL]-ACETAMIDE
SpectraBase Compound ID 96rd9dnOM4D
InChI InChI=1S/C11H16N2O7/c1-4(15)12-7-5(16)2-13-8(7)9(6(17)3-14)20-11(19)10(13)18/h5-9,14,16-17H,2-3H2,1H3,(H,12,15)/t5-,6+,7+,8?,9+/m1/s1
InChIKey UTLKHNPVNBVXIO-MYQIAPESSA-N
Mol Weight 288.26 g/mol
Molecular Formula C11H16N2O7
Exact Mass 288.095751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AEUHETQgqK
Name N-[(1S,7S,8S,8AR)-1-[(1'R)-1',2'-DIHYDROXYETHYL]-3,4,6,7,8,8A-HEXAHYDROXY-3,4-DIOXO-1H-PYRROLO-[1,2-D]-OXAZIN-8-YL]-ACETAMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H16N2O7
InChI InChI=1S/C11H16N2O7/c1-4(15)12-7-5(16)2-13-8(7)9(6(17)3-14)20-11(19)10(13)18/h5-9,14,16-17H,2-3H2,1H3,(H,12,15)/t5-,6+,7+,8?,9+/m1/s1
InChIKey UTLKHNPVNBVXIO-MYQIAPESSA-N
Literature Reference Author L.CZOLLNER,J.KUSZMANN,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,73,1338(1990)
Literature Reference DOI 10.1002/hlca.19900730522
Molecular Weight 288.257 g/mol
Solvent DMSO-D6
Source File Reference UWCS2640