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2,17-Dithia[3.3](3,3')biphenylophane S,S,S',S'-tetroxide

View entire compound with spectra: 1 MS (GC)

2,17-Dithia[3.3](3,3')biphenylophane S,S,S',S'-tetroxide
SpectraBase Compound ID FUz64GDvnhj
InChI InChI=1S/C28H24O4S2/c29-33(30)17-21-5-1-9-25(13-21)26-10-2-6-22(14-26)19-34(31,32)20-24-8-4-12-28(16-24)27-11-3-7-23(15-27)18-33/h1-16H,17-20H2
InChIKey NATSACUUOMOOPB-UHFFFAOYSA-N
Mol Weight 488.62 g/mol
Molecular Formula C28H24O4S2
Exact Mass 488.111602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 139w8FV1HDv
Name 2,17-Dithia[3.3](3,3')biphenylophane S,S,S',S'-tetroxide
Alternate Name(s) 8,21-dithiapentacyclo[21.3.1.1(2,6).1(10,14).1(15,19)]triaconta-1(27),2(30),3,5,10(29),11,13,15(28),16,18,23,25-dodecaene 8,8,21,21-tetraoxide
CAS Registry Number 66018-34-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24O4S2
InChI InChI=1S/C28H24O4S2/c29-33(30)17-21-5-1-9-25(13-21)26-10-2-6-22(14-26)19-34(31,32)20-24-8-4-12-28(16-24)27-11-3-7-23(15-27)18-33/h1-16H,17-20H2
InChIKey NATSACUUOMOOPB-UHFFFAOYSA-N
Molecular Weight 488.616 g/mol
SMILES C1S(=O)(=O)Cc2cc(-c3cc(CS(Cc4cc(-c5cc1ccc5)ccc4)(=O)=O)ccc3)ccc2
SPLASH splash10-017i-0901000000-6aa3a6274b45b6bd98de
Source of Spectrum J-43-2487-0
Wiley ID 1396891