Lignin_cw_compound_2062 (C21 H20 O8)

bmse010315 Data

Entry STAR file: bmse010315.str

NMR-STAR interactive viewer

Authors: Sally Ralph, John Ralph, Larry L. Landucci

From: NMR Database of Lignin and Cell Wall Model Compounds.

Natural Isotopic formula weight: 400.3787

This is of the category: b-b Dimers

Concentration: Saturated (Source: Stephane Quideau)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_2062 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C18A46.461
C19B48.061
C3AGOMe52.251
C1A3OMe56.181
C2B3OMe56.361
C7A2112.011
C8B2113.111
C4A5115.521
C9B5116.751
C4A6120.821
C13BB123.971
C11B1124.581
C12B6132.081
C10A1135.451
C6BA138.071
C14A4146.141
C17B3147.511
C16A3148.111
C15B4149.341
C20BG168.801
C21AG173.441
H36AGOMe3.551
H37AGOMe3.551
H38AGOMe3.551
H30A3OMe3.741
H31A3OMe3.741
H32A3OMe3.741
H35B3OMe3.871
H34B3OMe3.871
H33B3OMe3.871
H46B3.961
H45A4.511
H39A66.431
H40A56.6571
H44B56.6611
H42A26.771
H43B27.061
H41BA7.661