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1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1R)-2-NITROCYCLOHEXA-2,4-DIENYL]-D-MANNOPENTITOL

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1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1R)-2-NITROCYCLOHEXA-2,4-DIENYL]-D-MANNOPENTITOL
SpectraBase Compound ID KeOqtVDqsU7
InChI InChI=1S/C21H27NO12/c1-11(23)30-10-18(31-12(2)24)20(33-14(4)26)21(34-15(5)27)19(32-13(3)25)16-8-6-7-9-17(16)22(28)29/h6-7,9,16,18-21H,8,10H2,1-5H3/t16-,18?,19?,20?,21?/m1/s1
InChIKey BEPFYUSFPYARKJ-WXYKMOQMSA-N
Mol Weight 485.44 g/mol
Molecular Formula C21H27NO12
Exact Mass 485.153325 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LkjQMwBUaOu
Name 1',2',3',4',5'-PENTA-O-ACETYL-1'-C-[(1R)-2-NITROCYCLOHEXA-2,4-DIENYL]-D-MANNOPENTITOL
Compound Number 28B
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H27NO12/c1-11(23)30-10-18(31-12(2)24)20(33-14(4)26)21(34-15(5)27)19(32-13(3)25)16-8-6-7-9-17(16)22(28)29/h6-7,9,16,18-21H,8,10H2,1-5H3/t16-,18?,19?,20?,21?/m1/s1
InChIKey BEPFYUSFPYARKJ-WXYKMOQMSA-N
Literature Reference J.A.SERRANO,L.E.CACERES,E.ROMAN J.CHEM.SOC.PERKIN-1,1863(1995)
Solvent Chloroform-d