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

*Links on SpectraBase are not permalinks.

2,3,8,9-Tetrahydroanthra[9,1-bc:10,5-B'C']dipyran-2,8-dicarboxylic acid

View entire compound with spectra: 1 NMR, and 1 FTIR

2,3,8,9-Tetrahydroanthra[9,1-bc:10,5-B'C']dipyran-2,8-dicarboxylic acid
SpectraBase Compound ID BOAFzBA98bZ
InChI InChI=1S/C20H14O6/c21-19(22)13-7-9-3-1-5-11-15(9)18(26-13)12-6-2-4-10-8-14(20(23)24)25-17(11)16(10)12/h1-6,13-14H,7-8H2,(H,21,22)(H,23,24)
InChIKey WJMWIEOPDVCYDE-UHFFFAOYSA-N
Mol Weight 350.33 g/mol
Molecular Formula C20H14O6
Exact Mass 350.079038 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 JD05THlqOP7
Name 2,3,8,9-Tetrahydroanthra[9,1-bc:10,5-B'C']dipyran-2,8-dicarboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.079038165 u
Formula C20H14O6
InChI InChI=1S/C20H14O6/c21-19(22)13-7-9-3-1-5-11-15(9)18(26-13)12-6-2-4-10-8-14(20(23)24)25-17(11)16(10)12/h1-6,13-14H,7-8H2,(H,21,22)(H,23,24)
InChIKey WJMWIEOPDVCYDE-UHFFFAOYSA-N
Molecular Weight 350.326 g/mol
SMILES OC(C1CC2=CC=CC3=C2C(=C2C4=C3OC(C(=O)O)CC4=CC=C2)O1)=O