Lignin_cw_compound_1029 (C21 H24 O8)

bmse010283 Data

Entry STAR file: bmse010283.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: 404.41046

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

Concentration: Saturated (Source: Richard F. Helm)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_1029 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe20.584
C2AcMe20.974
C3OMe56.214
C4OMe56.304
C12G63.861
C21A75.871
C20B80.991
C11A2111.891
C7B2113.771
C10A5115.641
C8B5119.131
C9A6121.191
C6B6121.671
C5B1123.571
C15A1129.171
C16A4147.711
C19A3148.261
C18B4149.311
C17B3151.831
C13AcC=O169.954
C14AcC=O170.664
H52A6.041
H51B4.771
H49G14.211
H50G23.951