Lignin_cw_compound_2028 (C20 H20 O7)

bmse010470 Data

Entry STAR file: bmse010470.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: 372.3686

This is of the category: b-b Dimers

Concentration: Saturated (Source: John Ralph Lab)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_2028 image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C12BB45.431
C17B54.801
C2A3OMe56.001
C1B3OMe56.131
C9BG68.661
C9BG80.371
C20G83.701
C7B2107.471
C8A2108.171
C6A5114.411
C5B5114.651
C3B6117.761
C4A6118.111
C10B1127.901
C11A1132.461
C14A4145.331
C13B4145.561
C16A3146.671
C15B3146.801
C20G177.071

Solvent: Acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C12BB46.141
C17B55.351
C2A3OMe56.261
C1B3OMe56.341
C9BG69.981
C9BG81.091
C20G84.561
C7B2109.501
C8A2110.241
C6A5115.651
C5B5115.871
C3B6118.571
C4A6119.171
C10B1129.221
C11A1133.481
C14A4147.101
C13B4147.241
C16A3148.391
C15B3148.541
C20G177.771
H45B3.651
H42BB3.711
HXG5.161
H44BA5.821
H40BGcis3.801
H41BGtrans3.471