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1-butanoyl-2,4,5-trihydroxy-7-methoxy-anthracene-9,10-dione
SpectraBase Compound ID FpWhDSAPdVa
InChI InChI=1S/C19H16O7/c1-3-4-10(20)15-12(22)7-13(23)16-17(15)18(24)9-5-8(26-2)6-11(21)14(9)19(16)25/h5-7,21-23H,3-4H2,1-2H3
InChIKey GHWOYWBEOYLCPN-UHFFFAOYSA-N
Mol Weight 356.33 g/mol
Molecular Formula C19H16O7
Exact Mass 356.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FE30PBkcAQt
Name 1-butanoyl-2,4,5-trihydroxy-7-methoxy-anthracene-9,10-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O7
InChI InChI=1S/C19H16O7/c1-3-4-10(20)15-12(22)7-13(23)16-17(15)18(24)9-5-8(26-2)6-11(21)14(9)19(16)25/h5-7,21-23H,3-4H2,1-2H3
InChIKey GHWOYWBEOYLCPN-UHFFFAOYSA-N
Molecular Weight 356.330 g/mol
SMILES Oc1cc(cc2C(c3c(c(cc(c3C(CCC)=O)O)O)C(c12)=O)=O)OC
SPLASH splash10-03di-0009000000-be45423c54d2c9d474e9
Source of Spectrum X2-50-1082-7
Synonyms 1-butanoyl-7-methoxy-2,4,5-tris(oxidanyl)anthracene-9,10-dione 1-butyryl-2,4,5-trihydroxy-7-methoxy-9,10-anthraquinone 2,4,5-trihydroxy-7-methoxy-1-(1-oxobutyl)anthracene-9,10-dione
Wiley ID 1602496