Lignin_cw_compound_1027 (C18 H18 O6)

bmse010281 Data

Entry STAR file: bmse010281.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: 330.33192

This is of the category: b-O-4 Dimers, 2-Carbon Sidechain

Concentration: Saturated (Source: Richard F. Helm)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_1027 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe20.441
C2OMe56.214
C3OMe56.444
C11B72.501
C10A2112.661
C6B2113.631
C7B5115.721
C5B6121.541
C8A6122.131
C6B1122.791
C9A5123.991
C13A1134.591
C17A4145.221
C16B4148.971
C15B3150.881
C18A3152.581
C12AcC=O168.631
C14A194.311
H41B5.431
H42B5.431