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Rubianthraquinone
SpectraBase Compound ID 8NW8ldFIlj3
InChI InChI=1S/C16H12O5/c1-7-12(18)6-11-13(16(7)21-2)15(20)9-4-3-8(17)5-10(9)14(11)19/h3-6,17-18H,1-2H3
InChIKey FDRWSVGPMGRFGX-UHFFFAOYSA-N
Mol Weight 284.27 g/mol
Molecular Formula C16H12O5
Exact Mass 284.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6SMWdAglQx
Name Rubianthraquinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O5
InChI InChI=1S/C16H12O5/c1-7-12(18)6-11-13(16(7)21-2)15(20)9-4-3-8(17)5-10(9)14(11)19/h3-6,17-18H,1-2H3
InChIKey FDRWSVGPMGRFGX-UHFFFAOYSA-N
Molecular Weight 284.267 g/mol
SMILES Oc1c(c(c2c(C(c3cc(ccc3C2=O)O)=O)c1)OC)C
SPLASH splash10-001i-0090000000-0a490abe37ca91dc1aa2
Source of Spectrum E2-51-660-5
Synonyms 3,6-dihydroxy-1-methoxy-2-methylanthracene-9,10-dione 3,6-dihydroxy-1-methoxy-2-methyl-anthracene-9,10-dione 1-methoxy-2-methyl-3,6-bis(oxidanyl)anthracene-9,10-dione
Wiley ID 1556170