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3-(1'-Hydroxyanthracene-9',10'-dion-4'-yl)propionoic acid
SpectraBase Compound ID A2KT8kT2kAl
InChI InChI=1S/C17H12O5/c18-12-7-5-9(6-8-13(19)20)14-15(12)17(22)11-4-2-1-3-10(11)16(14)21/h1-5,7,18H,6,8H2,(H,19,20)
InChIKey HLLCIFLPFSPWDK-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C17H12O5
Exact Mass 296.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GzgzaBRCz2
Name 3-(1'-Hydroxyanthracene-9',10'-dion-4'-yl)propionoic acid
Alternate Name(s) 3-(4-hydroxy-9,10-dioxo-9,10-dihydro-1-anthracenyl)propanoic acid
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Formula C17H12O5
InChI InChI=1S/C17H12O5/c18-12-7-5-9(6-8-13(19)20)14-15(12)17(22)11-4-2-1-3-10(11)16(14)21/h1-5,7,18H,6,8H2,(H,19,20)
InChIKey HLLCIFLPFSPWDK-UHFFFAOYSA-N
Molecular Weight 296.278 g/mol
SMILES OC(CCc1c2C(c3ccccc3C(c2c(cc1)O)=O)=O)=O
SPLASH splash10-0002-0090000000-a8509796786c4f2f75e7
Source of Spectrum F-53-4408-56
Wiley ID 801216