For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(5R,6S)-6-NITRO-5-(1',2',3',4',5'-PENTA-O-ACETYL-D-MANNOPENTITOL-1'-YL)-CYCLOHEX-2-ENONE

View entire compound with spectra: 1 NMR

(5R,6S)-6-NITRO-5-(1',2',3',4',5'-PENTA-O-ACETYL-D-MANNOPENTITOL-1'-YL)-CYCLOHEX-2-ENONE
SpectraBase Compound ID 2JB9x4nTegJ
InChI InChI=1S/C21H27NO13/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/h6,8,15,17-21H,7,9H2,1-5H3/t15-,17?,18+,19?,20?,21?/m1/s1
InChIKey WGOOTNFHBZCWTA-UZGUZFLGSA-N
Mol Weight 501.44 g/mol
Molecular Formula C21H27NO13
Exact Mass 501.14824 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Kb000UkQpiq
Name (5R,6S)-6-NITRO-5-(1',2',3',4',5'-PENTA-O-ACETYL-D-MANNOPENTITOL-1'-YL)-CYCLOHEX-2-ENONE
Compound Number 16B
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H27NO13/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/h6,8,15,17-21H,7,9H2,1-5H3/t15-,17?,18+,19?,20?,21?/m1/s1
InChIKey WGOOTNFHBZCWTA-UZGUZFLGSA-N
Literature Reference J.A.SERRANO,L.E.CACERES,E.ROMAN J.CHEM.SOC.PERKIN-1,1863(1995)
Solvent Chloroform-d