BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Vinyl guaiacol (C9 H10 O2)

bmse010071 Data

Entry STAR file: bmse010071.str

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

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

Natural Isotopic formula weight: 150.1745

This is of the category: Monomers

Concentration: 60 mg/ml (Source: John Ralph)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

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Vinyl guaiacol image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C2OMe55.861
C62108.141
C1B111.381
C55114.401
C66120.031
C71130.261
C3A136.621
C8A4145.641
C9A3146.631

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C2OMe56.171
C62109.851
C1B111.091
C55115.691
C66120.581
C71130.591
C3A137.701
C8A4147.551
C9A3148.381
H14OMe3.841
H15OMe3.841
H16OMe3.841
H12B15.041
H13B25.621
H17A6.631
H19A56.781
H18A66.901
H20A27.071

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C2OMe55.521
C62109.611
C1B110.811
C55115.341
C66119.461
C71128.771
C3A136.631
C8A4146.681
C9A3147.641