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7-CHLORO-1-O-METHYLEMODIN
SpectraBase Compound ID HAVsjTJw7fV
InChI InChI=1S/C16H11ClO5/c1-6-3-7-11(10(4-6)22-2)15(20)12-8(14(7)19)5-9(18)13(17)16(12)21/h3-5,18,21H,1-2H3
InChIKey CLRXTBMRGOWHGZ-UHFFFAOYSA-N
Mol Weight 318.71 g/mol
Molecular Formula C16H11ClO5
Exact Mass 318.029501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52fXlKhMvyB
Name 2-chloranyl-8-methoxy-6-methyl-1,3-bis(oxidanyl)anthracene-9,10-dione
Comments Less than 3 mono-isotopic peaks
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Formula C16H11ClO5
InChI InChI=1S/C16H11ClO5/c1-6-3-7-11(10(4-6)22-2)15(20)12-8(14(7)19)5-9(18)13(17)16(12)21/h3-5,18,21H,1-2H3
InChIKey CLRXTBMRGOWHGZ-UHFFFAOYSA-N
Molecular Weight 318.712 g/mol
SMILES Oc1c(c(cc2C(c3cc(cc(c3C(c12)=O)OC)C)=O)O)Cl
SPLASH splash10-014i-0009000000-a4a709382cee30095904
Source of Spectrum X4-58-525-3
Synonyms 2-chloro-1,3-dihydroxy-8-methoxy-6-methyl-9,10-anthraquinone 2-chloro-1,3-dihydroxy-8-methoxy-6-methyl-anthracene-9,10-dione
Wiley ID 1605913