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3,11-Dithia-17,18-diazatricyclo[11.3.1.1(5,9)]octadeca-1(17),5,7,9(18),13,15-hexaene, 3,3,11,11,17,18-hexaoxide
SpectraBase Compound ID C20AaQRwPjz
InChI InChI=1S/C14H14N2O6S2/c17-15-11-3-1-4-12(15)8-24(21,22)10-14-6-2-5-13(16(14)18)9-23(19,20)7-11/h1-6H,7-10H2
InChIKey ZHYGDOLJBLORMF-UHFFFAOYSA-N
Mol Weight 370.39 g/mol
Molecular Formula C14H14N2O6S2
Exact Mass 370.029329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KRciHEIP9G9
Name 3,11-Dithia-17,18-diazatricyclo[11.3.1.1(5,9)]octadeca-1(17),5,7,9(18),13,15-hexaene, 3,3,11,11,17,18-hexaoxide
CAS Registry Number 34535-48-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O6S2
InChI InChI=1S/C14H14N2O6S2/c17-15-11-3-1-4-12(15)8-24(21,22)10-14-6-2-5-13(16(14)18)9-23(19,20)7-11/h1-6H,7-10H2
InChIKey ZHYGDOLJBLORMF-UHFFFAOYSA-N
Molecular Weight 370.394 g/mol
SMILES C1S(Cc2[n+](c(CS(Cc3[n+](c1ccc3)[O-])(=O)=O)ccc2)[O-])(=O)=O
SPLASH splash10-0a4i-0693000000-7e8fb98a235b054949c7
Source of Spectrum B-32-1247-0
Synonyms 2,11-Dithia[3,3](2,6)pyridinophane 2,2,5,11,11,14-hexaoxide 3,11-dithia-17,18-diazatricyclo[11.3.1.1(5,9)]octadeca-1(17),5(18),6,8,13,15-hexaene 3,3,11,11,17,18-hexaoxide
Wiley ID 1353958