For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

5-Methoxy-1-hydroxy-2-(2'-methylprop-1'-enyl)-6-(prop-2""-enyl)anthraquinone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-Methoxy-1-hydroxy-2-(2'-methylprop-1'-enyl)-6-(prop-2""-enyl)anthraquinone
SpectraBase Compound ID J1BSejRdVsz
InChI InChI=1S/C22H20O4/c1-5-6-13-7-9-16-18(22(13)26-4)21(25)15-10-8-14(11-12(2)3)19(23)17(15)20(16)24/h5,7-11,23H,1,6H2,2-4H3
InChIKey XXIKEPAIRHJECW-UHFFFAOYSA-N
Mol Weight 348.4 g/mol
Molecular Formula C22H20O4
Exact Mass 348.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3esKabU8EGs
Name 5-Methoxy-1-hydroxy-2-(2'-methylprop-1'-enyl)-6-(prop-2""-enyl)anthraquinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.136159120 u
Formula C22H20O4
InChI InChI=1S/C22H20O4/c1-5-6-13-7-9-16-18(22(13)26-4)21(25)15-10-8-14(11-12(2)3)19(23)17(15)20(16)24/h5,7-11,23H,1,6H2,2-4H3
InChIKey XXIKEPAIRHJECW-UHFFFAOYSA-N
Molecular Weight 348.398 g/mol
SMILES C=12C(C=3C=CC(=C(C3C(C2=CC=C(C1O)C=C(C)C)=O)OC)CC=C)=O