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3,12-Dithiatricyclo[12.2.2.2(6,9)]eicosa-6,8,14,16,17,19-hexaene, 3,3,12,12-tetraoxide
SpectraBase Compound ID CJ4xcn8bVuz
InChI InChI=1S/C18H20O4S2/c19-23(20)11-9-15-1-2-16(4-3-15)10-12-24(21,22)14-18-7-5-17(13-23)6-8-18/h1-8H,9-14H2
InChIKey QKBUFTKCZOLCQJ-UHFFFAOYSA-N
Mol Weight 364.47 g/mol
Molecular Formula C18H20O4S2
Exact Mass 364.080301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1E0a370uGcy
Name 3,12-Dithiatricyclo[12.2.2.2(6,9)]eicosa-6,8,14,16,17,19-hexaene, 3,3,12,12-tetraoxide
CAS Registry Number 62587-10-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O4S2
InChI InChI=1S/C18H20O4S2/c19-23(20)11-9-15-1-2-16(4-3-15)10-12-24(21,22)14-18-7-5-17(13-23)6-8-18/h1-8H,9-14H2
InChIKey QKBUFTKCZOLCQJ-UHFFFAOYSA-N
Molecular Weight 364.474 g/mol
SMILES C1S(=O)(=O)CCc2ccc(CCS(Cc3ccc1cc3)(=O)=O)cc2
SPLASH splash10-0udi-0910000000-a9825943bdda1279528e
Source of Spectrum K-112-256-4
Synonyms 2,13-Dithia[4.4]paracyclophan-s,S,s',s'-tetraoxide 2,13-Dithia[4.4]paracyclophane s,S,s',s'-tetraoxide 3,12-dithiatricyclo[12.2.2.2(6,9)]icosa-1(16),6,8,14,17,19-hexaene 3,3,12,12-tetraoxide
Wiley ID 1350642