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2,3,4,6-TETRA-O-(3-BENZOYLPROPIONYL)-ALPHA-D-MANNOPYRANOSE

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2,3,4,6-TETRA-O-(3-BENZOYLPROPIONYL)-ALPHA-D-MANNOPYRANOSE
SpectraBase Compound ID JeRTqJNPVbY
InChI InChI=1S/C46H44O14/c47-34(30-13-5-1-6-14-30)21-25-39(51)56-29-38-43(58-40(52)26-22-35(48)31-15-7-2-8-16-31)44(59-41(53)27-23-36(49)32-17-9-3-10-18-32)45(46(55)57-38)60-42(54)28-24-37(50)33-19-11-4-12-20-33/h1-20,38,43-46,55H,21-29H2/t38-,43-,44+,45+,46+/m1/s1
InChIKey KIVFXQMWLRUFTM-UUZVNGIASA-N
Mol Weight 820.8 g/mol
Molecular Formula C46H44O14
Exact Mass 820.273106 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CkcfP2fs3ry
Name 2,3,4,6-TETRA-O-(3-BENZOYLPROPIONYL)-ALPHA-D-MANNOPYRANOSE
Comments 2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C46H44O14
InChI InChI=1S/C46H44O14/c47-34(30-13-5-1-6-14-30)21-25-39(51)56-29-38-43(58-40(52)26-22-35(48)31-15-7-2-8-16-31)44(59-41(53)27-23-36(49)32-17-9-3-10-18-32)45(46(55)57-38)60-42(54)28-24-37(50)33-19-11-4-12-20-33/h1-20,38,43-46,55H,21-29H2/t38-,43-,44+,45+,46+/m1/s1
InChIKey KIVFXQMWLRUFTM-UUZVNGIASA-N
Instrument Name Bruker WM-250
Literature Reference A.V.NIKOLAEV, I.A.IVANOVA, V.N.SHIBAEV, N.K.KOCHETKOV (1990)Bioorganich.Khim.(Russ. Lang.): v.16, N8, 1105-1117.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3