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1,18-Dibromo-2,8,11,17,19,25,28,34-octaoxa-5,14,22,31-tetrathia-1,18(1,2)-dibenzenacyclotetratriacontaphane
SpectraBase Compound ID 55RJWWlhBjJ
InChI InChI=1S/C32H46Br2O8S4/c33-27-1-3-29-31(25-27)41-15-23-45-19-11-37-8-6-36-10-18-44-22-14-40-30-4-2-28(34)26-32(30)42-16-24-46-20-12-38-7-5-35-9-17-43-21-13-39-29/h1-4,25-26H,5-24H2
InChIKey NMHQWVYILYENGY-UHFFFAOYSA-N
Mol Weight 846.8 g/mol
Molecular Formula C32H46Br2O8S4
Exact Mass 844.044229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3wGnuJskMEX
Name 1,18-Dibromo-2,8,11,17,19,25,28,34-octaoxa-5,14,22,31-tetrathia-1,18(1,2)-dibenzenacyclotetratriacontaphane
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Formula C32H46Br2O8S4
InChI InChI=1S/C32H46Br2O8S4/c33-27-1-3-29-31(25-27)41-15-23-45-19-11-37-8-6-36-10-18-44-22-14-40-30-4-2-28(34)26-32(30)42-16-24-46-20-12-38-7-5-35-9-17-43-21-13-39-29/h1-4,25-26H,5-24H2
InChIKey NMHQWVYILYENGY-UHFFFAOYSA-N
Molecular Weight 846.760 g/mol
SMILES c12cc(Br)ccc2OCCSCCOCCOCCSCCOc2c(OCCSCCOCCOCCSCCO1)ccc(Br)c2
SPLASH splash10-0cdj-0890000000-a4f71c7bfb3e2fa522e6
Source of Spectrum KC-0-1446-19
Synonyms 20,42-dibromo-2,8,11,17,24,30,33,39-octaoxa-5,14,27,36-tetrathiatricyclo[38.4.0.0(18,23)]tetratetraconta-1(40),18,20,22,41,43-hexaene
Wiley ID 821922