Guaiacylglycerol-B-guaiacyl Ether (C17 H20 O6)

bmse010041 Data

Entry STAR file: bmse010041.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: 320.3371

This is of the category: b-O-4 Dimers, 3-Carbon Sidechain

Concentration: Saturated (Source: John Ralph Lab)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

Guaiacylglycerol-B-guaiacyl Ether image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe55.864
C2OMe55.944
C10G60.751
C17A72.781
C16B87.021
C9A2108.811
C5B2112.191
C8A5114.311
C6B5119.071
C7A6120.571
C4B6121.591
C3B1124.001
C11A1131.951
C12A4145.091
C15A3146.641
C14B4146.891
C13B3151.401
H25OMe3.834
H24OMe3.834
H26OMe3.834
H27OMe3.844
H28OMe3.844
H29OMe3.844
H40A4.951
H39B4.161

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe56.204
C2OMe56.274
C10G61.811
C17A73.821
C16B86.721
C9A2111.381
C5B2113.501
C8A5115.121
C6B5119.701
C7A6120.451
C4B6121.851
C3B1123.321
C11A1134.231
C12A4146.611
C15A3147.931
C14B4149.041
C13B3151.961

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe55.354
C2OMe55.524
C10G60.041
C17A71.601
C16B83.671
C9A2111.351
C5B2112.601
C8A5114.481
C6B5115.861
C7A6119.431
C4B6120.561
C3B1120.891
C11A1133.151
C12A4145.351
C15A3146.861
C14B4148.001
C13B3149.681