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7,10-Dimethoxy-2,15-dithia[5.5]paracyclophane - 2,2,15,15-tetraoxide
SpectraBase Compound ID G6mMk3cZsCs
InChI InChI=1S/C22H28O6S2/c1-27-21-13-20-6-4-12-30(25,26)16-18-9-7-17(8-10-18)15-29(23,24)11-3-5-19(21)14-22(20)28-2/h7-10,13-14H,3-6,11-12,15-16H2,1-2H3
InChIKey CJKGEWUYQNINQF-UHFFFAOYSA-N
Mol Weight 452.58 g/mol
Molecular Formula C22H28O6S2
Exact Mass 452.132731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JQMF41ZMyW
Name 7,10-Dimethoxy-2,15-dithia[5.5]paracyclophane - 2,2,15,15-tetraoxide
Alternate Name(s) 8,21-dimethoxy-3,14-dithiatricyclo[14.2.2.2(7,10)]docosa-1(18),7,9,16,19,21-hexaene 3,3,14,14-tetraoxide
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Formula C22H28O6S2
InChI InChI=1S/C22H28O6S2/c1-27-21-13-20-6-4-12-30(25,26)16-18-9-7-17(8-10-18)15-29(23,24)11-3-5-19(21)14-22(20)28-2/h7-10,13-14H,3-6,11-12,15-16H2,1-2H3
InChIKey CJKGEWUYQNINQF-UHFFFAOYSA-N
Molecular Weight 452.580 g/mol
SMILES C1S(=O)(=O)CCCc2cc(c(CCCS(Cc3ccc1cc3)(=O)=O)cc2OC)OC
SPLASH splash10-0udi-0800900000-9f1fe1f7039eae7c86d8
Source of Spectrum U1-1998-147-0
Wiley ID 750719