Lignin_cw_compound_285 (C11 H16 O6)

bmse010192 Data

Entry STAR file: bmse010192.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: 244.24114

This is of the category: Monomers

Concentration: Saturated (Source: Forest Products Laboratory)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_285 image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe56.401
C2OMe56.401
C5G63.241
C7B74.691
C10A75.991
C32103.031
C46103.031
C61131.601
C114134.571
C83147.281
C95147.281
H26G3.771
H27G3.771
H28B3.811
H18OMe3.911
H20OMe3.911
H19OMe3.911
H21OMe3.911
H23OMe3.911
H22OMe3.911
H29A4.771
H2426.641
H2566.641

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe56.601
C2OMe56.601
C5G64.241
C7B76.261
C10A76.261
C32105.321
C46105.321
C61133.981
C114135.901
C83148.321
C95148.321
H26G3.631
H27G3.631
H28B3.721
H18OMe3.811
H20OMe3.811
H19OMe3.811
H21OMe3.811
H23OMe3.811
H22OMe3.811
H29A4.601
H2426.711
H2566.711
H264OH7.091

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1OMe55.991
C2OMe55.991
C5G63.101
C7B75.491
C10A74.241
C32104.721
C46104.721
C61133.581
C114134.311
C83147.421
C95147.421
H26G3.421
H27G3.421
H28B3.491
H18OMe3.721
H20OMe3.721
H19OMe3.721
H21OMe3.721
H23OMe3.721
H22OMe3.721
H29A4.341
H2426.581
H2566.581