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5,13-Dithia[3]-(1,3)benzeno[3]-(3,5)pyridinophane - 1,5,5,13,13-pentoxide
SpectraBase Compound ID H05Rtp4tbIk
InChI InChI=1S/C15H15NO5S2/c17-16-6-14-5-15(7-16)11-23(20,21)9-13-3-1-2-12(4-13)8-22(18,19)10-14/h1-7H,8-11H2
InChIKey ZAOWIJONWOZGKP-UHFFFAOYSA-N
Mol Weight 353.41 g/mol
Molecular Formula C15H15NO5S2
Exact Mass 353.039165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IzFk7lBXjl
Name 5,13-Dithia[3]-(1,3)benzeno[3]-(3,5)pyridinophane - 1,5,5,13,13-pentoxide
Alternate Name(s) 3,11-dithia-7-azatricyclo[11.3.1.1(5,9)]octadeca-1(17),5(18),6,8,13,15-hexaene 3,3,7,11,11-pentaoxide
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Formula C15H15NO5S2
InChI InChI=1S/C15H15NO5S2/c17-16-6-14-5-15(7-16)11-23(20,21)9-13-3-1-2-12(4-13)8-22(18,19)10-14/h1-7H,8-11H2
InChIKey ZAOWIJONWOZGKP-UHFFFAOYSA-N
Molecular Weight 353.407 g/mol
SMILES C1S(Cc2cc(CS(Cc3c[n+](cc1c3)[O-])(=O)=O)ccc2)(=O)=O
SPLASH splash10-0a4i-0090000000-eb7eeb29271d94020fbe
Source of Spectrum U-1997-1223-2
Wiley ID 769831