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1,5-Dihydroxyanthra-9,10-quinone, bis(2-methylpropionate)

View entire compound with spectra: 1 NMR

1,5-Dihydroxyanthra-9,10-quinone, bis(2-methylpropionate)
SpectraBase Compound ID 6fHR3iv4HpO
InChI InChI=1S/C22H20O6/c1-11(2)21(25)27-15-9-5-7-13-17(15)19(23)14-8-6-10-16(18(14)20(13)24)28-22(26)12(3)4/h5-12H,1-4H3
InChIKey OFLKKXUTBDCFKN-UHFFFAOYSA-N
Mol Weight 380.4 g/mol
Molecular Formula C22H20O6
Exact Mass 380.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9gwJchm0P4z
Name 1,5-Dihydroxyanthra-9,10-quinone, bis(2-methylpropionate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.125988358 u
Formula C22H20O6
InChI InChI=1S/C22H20O6/c1-11(2)21(25)27-15-9-5-7-13-17(15)19(23)14-8-6-10-16(18(14)20(13)24)28-22(26)12(3)4/h5-12H,1-4H3
InChIKey OFLKKXUTBDCFKN-UHFFFAOYSA-N
Molecular Weight 380.396 g/mol
SMILES C1(OC(C(C)C)=O)=C2C(=CC=C1)C(=O)C=1C(C2=O)=CC=CC1OC(C(C)C)=O