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Fallacinol
SpectraBase Compound ID Aa9Aoij1bYi
InChI InChI=1S/C16H12O6/c1-22-8-4-10-14(12(19)5-8)16(21)13-9(15(10)20)2-7(6-17)3-11(13)18/h2-5,17-19H,6H2,1H3
InChIKey WJXSYUJKJSOJOG-UHFFFAOYSA-N
Mol Weight 300.27 g/mol
Molecular Formula C16H12O6
Exact Mass 300.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ejqfrqDcfm
Name 1,8-dihydroxy-3-(hydroxymethyl)-6-methoxy-anthracene-9,10-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O6
InChI InChI=1S/C16H12O6/c1-22-8-4-10-14(12(19)5-8)16(21)13-9(15(10)20)2-7(6-17)3-11(13)18/h2-5,17-19H,6H2,1H3
InChIKey WJXSYUJKJSOJOG-UHFFFAOYSA-N
Molecular Weight 300.266 g/mol
SMILES Oc1cc(cc2c1C(c1c(cc(CO)cc1C2=O)O)=O)OC
SPLASH splash10-0udi-0049000000-733e87e0c2229aff5265
Source of Spectrum J-58-7912-16
Synonyms 1,8-dihydroxy-3-methoxy-6-methylol-9,10-anthraquinone 3-(hydroxymethyl)-6-methoxy-1,8-bis(oxidanyl)anthracene-9,10-dione
Wiley ID 1302706