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1,8,11-Trimethoxy-3-methylbenz[a]anthracene-7,12-dione

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

1,8,11-Trimethoxy-3-methylbenz[a]anthracene-7,12-dione
SpectraBase Compound ID E9amlMO6e2
InChI InChI=1S/C22H18O5/c1-11-9-12-5-6-13-18(17(12)16(10-11)27-4)22(24)20-15(26-3)8-7-14(25-2)19(20)21(13)23/h5-10H,1-4H3
InChIKey BBPVPIRSTLCMJN-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 FPXstOPHx0C
Name 1,8,11-Trimethoxy-3-methylbenz[A]anthracene-7,12-dione
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/c1-11-9-12-5-6-13-18(17(12)16(10-11)27-4)22(24)20-15(26-3)8-7-14(25-2)19(20)21(13)23/h5-10H,1-4H3
InChIKey BBPVPIRSTLCMJN-UHFFFAOYSA-N
Molecular Weight 362.381 g/mol
SMILES C1=CC(=C2C(C=3C=CC=4C(C3C(C2=C1OC)=O)=C(C=C(C4)C)OC)=O)OC