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1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1S,5R,6R)-5-HYDROXY-6-NITROCYCLOHEX-3-ENYL]-D-GALAKTO-PENTITOL

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1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1S,5R,6R)-5-HYDROXY-6-NITROCYCLOHEX-3-ENYL]-D-GALAKTO-PENTITOL
SpectraBase Compound ID FbpznvfPRDg
InChI InChI=1S/C21H29NO13/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/h6,8,15-21,28H,7,9H2,1-5H3/t15-,16+,17?,18+,19?,20?,21?/m0/s1
InChIKey YFEDLLXSJBRGJN-ODJJGYIPSA-N
Mol Weight 503.46 g/mol
Molecular Formula C21H29NO13
Exact Mass 503.16389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Esa5pn1GsYK
Name 1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1S,5R,6R)-5-HYDROXY-6-NITROCYCLOHEX-3-ENYL]-D-GALAKTO-PENTITOL
Compound Number 6A
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H29NO13/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/h6,8,15-21,28H,7,9H2,1-5H3/t15-,16+,17?,18+,19?,20?,21?/m0/s1
InChIKey YFEDLLXSJBRGJN-ODJJGYIPSA-N
Literature Reference J.CHEM.SOC.PERKIN-1,1863(1995) J.A.SERRANO,L.E.CACERES,E.ROMAN
Solvent Chloroform-d