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1,6,11(2H)-Naphthacenetrione, 2-ethyl-3,4-dihydro-5,7-dihydroxy-

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

1,6,11(2H)-Naphthacenetrione, 2-ethyl-3,4-dihydro-5,7-dihydroxy-
SpectraBase Compound ID CvsEX3HE9f
InChI InChI=1S/C20H16O5/c1-2-9-6-7-10-12(17(9)22)8-13-16(19(10)24)20(25)15-11(18(13)23)4-3-5-14(15)21/h3-5,8-9,21,24H,2,6-7H2,1H3
InChIKey RWFMYBJMKIYNLV-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2NdCcAD349c
Name 1,6,11(2H)-Naphthacenetrione, 2-ethyl-3,4-dihydro-5,7-dihydroxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.099773610 u
Formula C20H16O5
InChI InChI=1S/C20H16O5/c1-2-9-6-7-10-12(17(9)22)8-13-16(19(10)24)20(25)15-11(18(13)23)4-3-5-14(15)21/h3-5,8-9,21,24H,2,6-7H2,1H3
InChIKey RWFMYBJMKIYNLV-UHFFFAOYSA-N
Molecular Weight 336.343 g/mol
SMILES C=12C(C=3C(O)=CC=CC3C(C2=CC2=C(C1O)CCC(CC)C2=O)=O)=O