Lignin_cw_compound_3042 (C26 H26 O12)

bmse010362 Data

Entry STAR file: bmse010362.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: 530.47744

This is of the category: b-b Dimers

Concentration: Saturated (Source: Sally Ralph)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_3042 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C2AcMe20.181
C1AcMe20.181
C20B48.761
C19B48.761
C53OMe55.561
C33OMe55.561
C65OMe55.561
C45OMe55.561
C22A82.611
C21A82.611
C92103.051
C72103.051
C106103.051
C86103.051
C244129.761
C234129.761
C141137.841
C131137.841
C173153.541
C153153.541
C185153.541
C165153.541
C12AcC=O168.501
C11AcC=O168.501
C26G175.771
C25G175.771
H44AcMe2.231
H42AcMe2.231
H43AcMe2.231
H39AcMe2.231
H40AcMe2.231
H41AcMe2.231
H52OMe3.811
H51OMe3.811
H53OMe3.811
H54OMe3.811
H56OMe3.811
H55OMe3.811
H45OMe3.811
H47OMe3.811
H46OMe3.811
H49OMe3.811
H50OMe3.811
H48OMe3.811
H62B4.201
H61B4.201
H64A5.861
H63A5.861
H5926.811
H5726.811
H6066.811
H5866.811