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

*Links on SpectraBase are not permalinks.
2-(1,8-Dihydroxy-3-methyl-9,10-dioxo-2-anthracenyl)-1,8-dihydroxy-3-methylanthracene-9,10-dione
SpectraBase Compound ID Gq29AX78xFB
InChI InChI=1S/C30H18O8/c1-11-9-15-23(29(37)21-13(25(15)33)5-3-7-17(21)31)27(35)19(11)20-12(2)10-16-24(28(20)36)30(38)22-14(26(16)34)6-4-8-18(22)32/h3-10,31-32,35-36H,1-2H3
InChIKey VUPMYTWJSPRETC-UHFFFAOYSA-N
Mol Weight 506.47 g/mol
Molecular Formula C30H18O8
Exact Mass 506.100168 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4pHxmVDGhHb
Name 2-(1,8-Dihydroxy-3-methyl-9,10-dioxo-2-anthracenyl)-1,8-dihydroxy-3-methylanthracene-9,10-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 506.100167532 u
Formula C30H18O8
InChI InChI=1S/C30H18O8/c1-11-9-15-23(29(37)21-13(25(15)33)5-3-7-17(21)31)27(35)19(11)20-12(2)10-16-24(28(20)36)30(38)22-14(26(16)34)6-4-8-18(22)32/h3-10,31-32,35-36H,1-2H3
InChIKey VUPMYTWJSPRETC-UHFFFAOYSA-N
Molecular Weight 506.466 g/mol
SMILES C=12C(C=3C(O)=CC=CC3C(C2=CC(=C(C=2C(=C3C(C=4C(O)=CC=CC4C(C3=CC2C)=O)=O)O)C1O)C)=O)=O