Lignin_cw_compound_3001 (C24 H26 O8)

bmse010330 Data

Entry STAR file: bmse010330.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: 442.45844

This is of the category: 5-O-4 Dimers

Concentration: Saturated (Source: Sally Ralph)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_3001 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C2ACH314.601
C1BCH314.601
C3B3OMe56.411
C4A3OMe56.771
C6ACH260.531
C5BCH260.641
C14A2107.991
C13B2112.661
C15A6114.451
C12AB116.991
C11BB117.931
C10B5118.361
C7B6122.841
C17A1126.671
C16B1131.041
C24A4141.411
C21A5144.451
C8BA144.811
C9AA144.941
C18B4149.351
C20A3150.121
C19B3151.411
C22BG167.151
C23AG167.161
H38ACH31.241
H37ACH31.241
H36ACH31.241
H35BCH31.271
H33BCH31.271
H34BCH31.271
H40B3OMe3.931
H39B3OMe3.931
H41B3OMe3.931
H44A3OMe3.961
H42A3OMe3.961
H43A3OMe3.961
H47ACH24.161
H48ACH24.161
H45BCH24.191
H46BCH24.191
H54AB6.361
H53BB6.481
H52B56.811
H57A66.891
H49B67.171
H56A27.221
H55B27.461
H51AA7.531
H50BA7.621