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1,8-dihydroxy-10-(4-hydroxyphenyl)sulfanyl-10H-anthracen-9-one
SpectraBase Compound ID 1DkgwoJIwdy
InChI InChI=1S/C20H14O4S/c21-11-7-9-12(10-8-11)25-20-13-3-1-5-15(22)17(13)19(24)18-14(20)4-2-6-16(18)23/h1-10,20-23H
InChIKey RDAMJAZCJDHAJQ-UHFFFAOYSA-N
Mol Weight 350.39 g/mol
Molecular Formula C20H14O4S
Exact Mass 350.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMs08q5wVdO
Name 1,8-dihydroxy-10-(4-hydroxyphenyl)sulfanyl-10H-anthracen-9-one
Alternate Name(s) 1,8-dihydroxy-10-[(4-hydroxyphenyl)thio]-10H-anthracen-9-one 10-(4-hydroxyphenyl)sulfanyl-1,8-bis(oxidanyl)-10H-anthracen-9-one
Comments Less than 3 mono-isotopic peaks
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Formula C20H14O4S
InChI InChI=1S/C20H14O4S/c21-11-7-9-12(10-8-11)25-20-13-3-1-5-15(22)17(13)19(24)18-14(20)4-2-6-16(18)23/h1-10,20-23H
InChIKey RDAMJAZCJDHAJQ-UHFFFAOYSA-N
Molecular Weight 350.388 g/mol
SMILES Oc1cccc2c1C(c1c(cccc1C2Sc1ccc(cc1)O)O)=O
SPLASH splash10-004i-0091000000-64eddbe650dd61a26f97
Source of Spectrum E1-39-3136-4
Wiley ID 1598881