Lignin_cw_compound_1006 (C32 H32 O11)

bmse010039 Data

Entry STAR file: bmse010039.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: 592.58988

This is of the category: More Trimers Containing Ferulic, Coumaric or p-OH-Benzoic Acid

Concentration: Saturated (Source: Richard F. Helm)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_1006 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe20.454
C2AcMe20.614
C3AcMe20.944
C4OMe56.224
C5OMe56.304
C19G63.161
C32A74.961
C30B80.441
C18A2112.791
C8B2113.801
C17CB118.671
C9B5119.891
C13A6120.451
C7B6121.681
C14C3123.241
C15C5123.241
C16A5123.401
C6B1124.081
C10C2130.281
C11C6130.281
C23C1132.821
C24A1136.631
C28A4140.831
C12CA145.121
C27B4148.391
C26B3152.061
C29A3152.141
C25C4153.581
C31CG165.791
C20AcC=O168.894
C21AcC=O169.424
C22AcC=O170.754
H72G14.291
H73G24.411
H74B4.931
H75A6.221
H70CB6.611
H65CA7.711