Lignin_cw_compound_3054 (C27 H30 O8)

bmse010511 Data

Entry STAR file: bmse010511.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: 482.5223

This is of the category: b-O-4 Dimers, 3-Carbon Sidechain

Concentration: Saturated (Source: John Ralph Lab)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_3054 image

Assigned chemical shifts

Solvent: Acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1CH314.351
C2BOMe56.361
C3AOMe56.441
C4AOMe56.441
C5CH261.291
C17CA75.061
C24A75.591
C26B84.381
C15A2105.441
C16A6105.441
C13B2113.871
C14B5117.251
C10B6121.611
C9B1123.441
C6C4128.311
C7C3128.761
C8C5128.761
C11C2128.821
C12C6128.821
C19A1136.701
C25A4137.611
C18C1139.471
C21B4148.701
C20B3151.031
C22A3154.171
C25A5154.171
C27G169.851
H38CH31.081
H37CH31.081
H36CH31.081
H40BOMe3.801
H39BOMe3.801
H41BOMe3.801
H44AOMe3.821
H42AOMe3.821
H43AOMe3.821
H45AOMe3.821
H46AOMe3.821
H47AOMe3.821
H48CH24.041
H49CH24.041
H64B4.721
H61CA4.931
H62CA4.931
H63A5.081
H59A26.831
H60A66.831
H58B56.811
H54B66.811
H53B16.951
H57B26.951
H51C37.311
H50C47.311
H52C57.311
H55C27.501
H56C67.501