Lignin_cw_compound_3055 (C27 H30 O8)

bmse010512 Data

Entry STAR file: bmse010512.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_3055 image

Assigned chemical shifts

Solvent: Acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1CH314.161
C2BOMe56.281
C3AOMe56.401
C4AOMe56.401
C5CH261.281
C24A74.841
C17CA75.041
C26B83.401
C15A2105.511
C16A6105.511
C13B2113.771
C14B5116.961
C10B6121.521
C9B1123.431
C50C4128.281
C7C3128.731
C8C5128.731
C11C2128.801
C12C6128.801
C25A4137.511
C19A1137.791
C18C1139.501
C21B4148.351
C20B3151.081
C22A3154.041
C23A5154.041
C27G170.251
H36CH31.191
H37CH31.191
H38CH31.191
H39BOMe3.771
H40BOMe3.771
H41BOMe3.771
H42AOMe3.831
H43AOMe3.831
H44AOMe3.831
H45AOMe3.831
H46AOMe3.831
H47AOMe3.831
H48CH24.161
H49CH24.161
H64B4.701
H61CA4.941
H62CA4.941
H63A5.071
H58B56.791
H54B66.791
H59A26.901
H60A66.901
H53B16.9351
H57B26.9351
H7C37.3051
H6C47.3051
H8C57.3051
H55C27.51
H56C67.51