Lignin_cw_compound_275 (C17 H18 O6)

bmse010184 Data

Entry STAR file: bmse010184.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: 318.32122

This is of the category: 5-5 Dimers

Concentration: Saturated (Source: Forest Products Laboratory)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_275 image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1G10.211
C4B31.901
C3BOMe56.191
C2AOMe56.391
C13A75.721
C8B2107.161
C6A2109.431
C11A5118.561
C5A6120.191
C7B6135.421
C9A1136.301
C16A4143.071
C12B5142.531
C14A3146.781
C15B3159.021
C17B4180.271
C10B1187.511
H26G0.931
H24G0.931
H25G0.931
H33B1.761
H34B1.761
H28BOMe3.861
H29BOMe3.861
H27BOMe3.861
H32AOMe3.931
H30AOMe3.931
H31AOMe3.931
H39A4.541
H40AOH5.931
H38B25.981
H35A66.741
H37B66.831
H36A26.981

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1G10.641
C4B33.211
C3BOMe56.461
C2AOMe56.841
C13A75.401
C8B2107.771
C6A2110.911
C11A5120.611
C5A6120.611
C7B6135.341
C9A1138.141
C16A4144.121
C12B5144.791
C14A3148.081
C15B3160.271
C17B4180.631
C10B1188.031
H26G0.911
H24G0.911
H25G0.911
H33B1.701
H34B1.701
H28AOMe3.881
H29AOMe3.881
H27AOMe3.881
H32BOMe3.891
H30BOMe3.891
H31BOMe3.891
H39A4.501
H38B26.071
H37B66.691
H35A66.771
H36A27.071
H41A4-OH7.761

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1G10.301
C4B32.031
C3BOMe55.871
C2AOMe56.571
C13A73.451
C8B2107.061
C6A2110.481
C11A5120.061
C5A6119.351
C7B6134.111
C9A1136.851
C16A4144.041
C12B5142.841
C14A3147.291
C15B3159.091
C17B4179.871
C10B1187.391
H26G0.821
H24G0.821
H25G0.821
H33B1.581
H34B1.581
H28OMe3.801
H29OMe3.801
H27OMe3.801
H32OMe3.801
H30OMe3.801
H31OMe3.801
H39A4.331
H40AOH5.061
H38B26.141
H37B66.611
H35A66.641
H36A26.961
H41A4-OH8.811