BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

sinapyl alcohol (C11 H14 O4)

bmse010286 Data

Entry STAR file: bmse010286.str

Authors: Sally Ralph, John Ralph, Larry L. Landucci

From: NMR Database of Lignin and Cell Wall Model Compounds.

Natural Isotopic formula weight: 210.22646

This is of the category: Monomers

Concentration: Saturated (Source: Stephane Quideau)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

sinapyl alcohol image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe56.271
C2OMe56.271
C5G63.761
C62103.351
C76103.351
C3B126.581
C81128.221
C4A131.501
C114134.801
C93147.131
C105147.131

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe56.481
C2OMe56.481
C5G63.331
C62104.651
C76104.651
C3B128.271
C81128.991
C4A130.621
C114136.521
C93148.711
C105148.711
H28GOH3.881
H16OMe3.821
H17OMe3.821
H18OMe3.821
H19OMe3.821
H20OMe3.821
H21OMe3.821
H24G4.201
H25G4.201
H22B6.241
H23A6.481
H2626.711
H2766.711
H294OH7.301

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe55.921
C2OMe55.921
C5G61.621
C62103.791
C76103.791
C3B127.891
C81127.401
C4A129.171
C114135.171
C93148.011
C105148.011