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2-Benzyl-1-hydroxy-3-methoxy-9,10-anthraquinone

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

2-Benzyl-1-hydroxy-3-methoxy-9,10-anthraquinone
SpectraBase Compound ID I5kSKh3ZX3Q
InChI InChI=1S/C22H16O4/c1-26-18-12-17-19(21(24)15-10-6-5-9-14(15)20(17)23)22(25)16(18)11-13-7-3-2-4-8-13/h2-10,12,25H,11H2,1H3
InChIKey HTLYJOYWAUQYNU-UHFFFAOYSA-N
Mol Weight 344.37 g/mol
Molecular Formula C22H16O4
Exact Mass 344.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 18Ltwunq1t2
Name 2-Benzyl-1-hydroxy-3-methoxy-9,10-anthraquinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.104858991 u
Formula C22H16O4
InChI InChI=1S/C22H16O4/c1-26-18-12-17-19(21(24)15-10-6-5-9-14(15)20(17)23)22(25)16(18)11-13-7-3-2-4-8-13/h2-10,12,25H,11H2,1H3
InChIKey HTLYJOYWAUQYNU-UHFFFAOYSA-N
Molecular Weight 344.366 g/mol
SMILES C=12C(C(=O)C3=C(C2=O)C=CC=C3)=CC(=C(C1O)CC=1C=CC=CC1)OC