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1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1S,2R,3R)-3-HYDROXY-2-NITROCYCLOHEXYL]-D-GALAKTO-PENTITOL

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1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1S,2R,3R)-3-HYDROXY-2-NITROCYCLOHEXYL]-D-GALAKTO-PENTITOL
SpectraBase Compound ID 4x71BZklo7i
InChI InChI=1S/C21H31NO13/c1-10(23)31-9-17(32-11(2)24)20(34-13(4)26)21(35-14(5)27)19(33-12(3)25)15-7-6-8-16(28)18(15)22(29)30/h15-21,28H,6-9H2,1-5H3/t15-,16+,17?,18+,19?,20?,21?/m0/s1
InChIKey JPNOKFLMBWWBDD-ODJJGYIPSA-N
Mol Weight 505.47 g/mol
Molecular Formula C21H31NO13
Exact Mass 505.17954 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J47lEMrd3ge
Name 1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1S,2R,3R)-3-HYDROXY-2-NITROCYCLOHEXYL]-D-GALAKTO-PENTITOL
Compound Number 18A
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H31NO13/c1-10(23)31-9-17(32-11(2)24)20(34-13(4)26)21(35-14(5)27)19(33-12(3)25)15-7-6-8-16(28)18(15)22(29)30/h15-21,28H,6-9H2,1-5H3/t15-,16+,17?,18+,19?,20?,21?/m0/s1
InChIKey JPNOKFLMBWWBDD-ODJJGYIPSA-N
Literature Reference J.A.SERRANO,L.E.CACERES,E.ROMAN J.CHEM.SOC.PERKIN-1,1863(1995)
Solvent Chloroform-d