Cis-coniferyl Alcohol (C10 H12 O3)

bmse010156 Data

Entry STAR file: bmse010156.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: 180.20048

This is of the category: Monomers

Concentration: 20 mg/ml (Source: John Ralph)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

Cis-coniferyl Alcohol image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe55.971
C6G59.751
C72111.531
C55114.331
C46122.251
C81129.041
C3A129.511
C2B131.101
C94145.171
C103146.381
H15OMe3.891
H16OMe3.891
H14OMe3.891
H21G4.441
H22G4.441
H17B5.791
H18A6.491
H1966.741
H2056.781
H2326.891

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe56.131
C6G59.731
C72113.191
C55115.551
C46122.781
C81129.731
C3A130.191
C2B131.441
C94146.691
C103147.931
H15OMe3.831
H16OMe3.831
H14OMe3.831
H21G4.411
H22G4.411
H17B5.731
H18A6.391
H1966.721
H2056.821
H2326.871

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe55.471
C6G58.161
C72112.841
C55115.151
C46121.561
C81128.061
C3A128.621
C2B130.951
C94145.741
C103147.131