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2,3,7,8-Tetrachlorothianthrene-1,4,6,9-tetrone
SpectraBase Compound ID LQ49yW9pPKO
InChI InChI=1S/C12Cl4O4S2/c13-1-2(14)6(18)10-9(5(1)17)21-11-7(19)3(15)4(16)8(20)12(11)22-10
InChIKey SFVNDVOREWHBHU-UHFFFAOYSA-N
Mol Weight 414.1 g/mol
Molecular Formula C12Cl4O4S2
Exact Mass 411.799212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmZAK7F9VCg
Name 2,3,7,8-Tetrachlorothianthrene-1,4,6,9-tetrone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12Cl4O4S2
InChI InChI=1S/C12Cl4O4S2/c13-1-2(14)6(18)10-9(5(1)17)21-11-7(19)3(15)4(16)8(20)12(11)22-10
InChIKey SFVNDVOREWHBHU-UHFFFAOYSA-N
Molecular Weight 414.060 g/mol
SMILES C1(C(=C(C(C=2SC=3C(C(=C(C(C3SC12)=O)Cl)Cl)=O)=O)Cl)Cl)=O
SPLASH splash10-03dr-7203900000-994b260620a7f0783a14
Source of Spectrum AJ-43-474-13
Synonyms 2,3,7,8-tetrachlorothianthrene-1,4,6,9-diquinone 2,3,7,8-tetrakis(chloranyl)thianthrene-1,4,6,9-tetrone
Wiley ID 1593933