Methyl P-Coumarate (C10 H10 O3)

bmse010222 Data

Entry STAR file: bmse010222.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: 178.1846

This is of the category: Monomers

Concentration: 136 mg/ml (Source: John Ralph)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

Methyl P-Coumarate image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1GOMe51.711
C7B114.981
C53115.951
C65115.951
C81126.981
C22130.001
C36130.001
C4A144.891
C94158.121
C10G168.181
H14GOMe3.801
H15GOMe3.801
H16GOMe3.801
H19A7.641
H2036.861
H2156.861
H1727.421
H1867.421
H22B6.281

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1GOMe51.491
C7B115.221
C53116.641
C65116.641
C81126.901
C22130.821
C36130.821
C4A145.331
C94160.451
C10G167.871

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1GOMe51.131
C7B113.901
C53115.781
C65115.781
C81125.071
C22130.211
C36130.211
C4A144.691
C94159.871
C10G166.991