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1H-Phenalen-1-one, 9-(3,4-dimethoxyphenyl)-4-hydroxy-2-methoxy-

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

1H-Phenalen-1-one, 9-(3,4-dimethoxyphenyl)-4-hydroxy-2-methoxy-
SpectraBase Compound ID Af5poeGLXdn
InChI InChI=1S/C22H18O5/c1-25-17-9-6-13(10-18(17)26-2)14-7-4-12-5-8-16(23)15-11-19(27-3)22(24)21(14)20(12)15/h4-11,23H,1-3H3
InChIKey AZDXQTSQRKQRME-UHFFFAOYSA-N
Mol Weight 362.38 g/mol
Molecular Formula C22H18O5
Exact Mass 362.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EvQB65bM1EG
Name 1H-Phenalen-1-one, 9-(3,4-dimethoxyphenyl)-4-hydroxy-2-methoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.115423675 u
Formula C22H18O5
InChI InChI=1S/C22H18O5/c1-25-17-9-6-13(10-18(17)26-2)14-7-4-12-5-8-16(23)15-11-19(27-3)22(24)21(14)20(12)15/h4-11,23H,1-3H3
InChIKey AZDXQTSQRKQRME-UHFFFAOYSA-N
Molecular Weight 362.381 g/mol
SMILES C=12C3=C(C(O)=CC=C3C=CC1C=1C=C(OC)C(=CC1)OC)C=C(C2=O)OC