Acetylated Coumaric Acid (C11 H10 O4)

bmse010066 Data

Entry STAR file: bmse010066.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: 206.1947

This is of the category: Monomers

Concentration: 120 mg/ml (Source: Irwin A. Pearl)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

Acetylated Coumaric Acid image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe21.121
C7B117.381
C53122.221
C65122.221
C22129.481
C36129.481
C91131.821
C4A145.801
C104152.501
C8AcC=O168.981
C11G171.141
H16AcMe2.311
H17AcMe2.311
H18AcMe2.311
H24B6.411
H2237.151
H2357.151
H1927.571
H2067.571
H21A7.751

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe20.961
C7B119.321
C53123.191
C65123.191
C22130.071
C36130.071
C91133.041
C4A144.441
C104153.411
C8AcC=O167.681
C11G169.391

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe20.761
C7B119.291
C53122.281
C65122.281
C22129.321
C36129.321
C91131.891
C4A142.881
C104151.801
C8AcC=O167.481
C11G168.921