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1,5-Dihydroxy-2-(phenylthio)-8-nitroanthraquinone
SpectraBase Compound ID IdCv46IxELJ
InChI InChI=1S/C20H11NO6S/c22-13-8-7-12(21(26)27)16-17(13)18(23)11-6-9-14(19(24)15(11)20(16)25)28-10-4-2-1-3-5-10/h1-9,22,24H
InChIKey ANIZHXAVBZEJFD-UHFFFAOYSA-N
Mol Weight 393.37 g/mol
Molecular Formula C20H11NO6S
Exact Mass 393.030708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8Z178UQigS
Name 1,5-Dihydroxy-2-(phenylthio)-8-nitroanthraquinone
Alternate Name(s) 1,5-Dihydroxy-8-nitro-2-(phenylsulfanyl)anthra-9,10-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H11NO6S
InChI InChI=1S/C20H11NO6S/c22-13-8-7-12(21(26)27)16-17(13)18(23)11-6-9-14(19(24)15(11)20(16)25)28-10-4-2-1-3-5-10/h1-9,22,24H
InChIKey ANIZHXAVBZEJFD-UHFFFAOYSA-N
Molecular Weight 393.369 g/mol
SMILES Oc1c(ccc2c1C(c1c(c(ccc1N(=O)=O)O)C2=O)=O)Sc1ccccc1
SPLASH splash10-0006-7009000000-0a048bb81bd614761dda
Source of Spectrum IC-1095-0-0
Wiley ID 1366221