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1,3-benzodithiole-1,1,3,3-tetraoxide-2-spiro-2',5'-dimethylcyclopentane
SpectraBase Compound ID 1JYGPJ9EY1G
InChI InChI=1S/C13H16O4S2/c1-9-7-8-10(2)13(9)18(14,15)11-5-3-4-6-12(11)19(13,16)17/h3-6,9-10H,7-8H2,1-2H3
InChIKey FGKKIKIIXVUXED-UHFFFAOYSA-N
Mol Weight 300.39 g/mol
Molecular Formula C13H16O4S2
Exact Mass 300.049001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABXNuCKBewR
Name 1,3-benzodithiole-1,1,3,3-tetraoxide-2-spiro-2',5'-dimethylcyclopentane
CAS Registry Number 121163-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4S2
InChI InChI=1S/C13H16O4S2/c1-9-7-8-10(2)13(9)18(14,15)11-5-3-4-6-12(11)19(13,16)17/h3-6,9-10H,7-8H2,1-2H3
InChIKey FGKKIKIIXVUXED-UHFFFAOYSA-N
Molecular Weight 300.387 g/mol
SMILES C12(S(c3c(S2(=O)=O)cccc3)(=O)=O)C(CCC1C)C
SPLASH splash10-0ku2-9000000000-fec81fe5502b090db984
Source of Spectrum F-44-6860-6
Synonyms 2',5'-dimethylspiro[1,3-benzodithiole-2,1'-cyclopentane]-1,1,3,3-tetrone
Wiley ID 1302452