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1,4-Dihydroxy 2-p-chloro phenylamino thioethoxy anthraquinone
SpectraBase Compound ID HXibOCxSmE
InChI InChI=1S/C22H16ClNO4S/c23-12-5-7-13(8-6-12)24-9-10-29-17-11-16(25)18-19(22(17)28)21(27)15-4-2-1-3-14(15)20(18)26/h1-8,11,24-25,28H,9-10H2
InChIKey ZOFHLJOTNSGINS-UHFFFAOYSA-N
Mol Weight 425.89 g/mol
Molecular Formula C22H16ClNO4S
Exact Mass 425.048857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5hBVkzn4Xgx
Name 1,4-Dihydroxy 2-p-chloro phenylamino thioethoxy anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16ClNO4S
InChI InChI=1S/C22H16ClNO4S/c23-12-5-7-13(8-6-12)24-9-10-29-17-11-16(25)18-19(22(17)28)21(27)15-4-2-1-3-14(15)20(18)26/h1-8,11,24-25,28H,9-10H2
InChIKey ZOFHLJOTNSGINS-UHFFFAOYSA-N
Molecular Weight 425.886 g/mol
SMILES Oc1c2c(c(cc1SCCNc1ccc(Cl)cc1)O)C(c1ccccc1C2=O)=O
SPLASH splash10-000f-0930200000-6baca200c05386c745d7
Source of Spectrum JX-2015-6-9049
Synonyms 2-((2-((4-chlorophenyl)amino)ethyl)thio)-1,4-dihydroxyanthracene-9,10-dione
Wiley ID 1730147