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16,18-Diphenyl-2,11-dithia[3]metacyclo-[3](3,5)-pyranophan-l4-one, 2,2,11,11-tetroxide
SpectraBase Compound ID 9BiWZj5Pt7S
InChI InChI=1S/C27H22O6S2/c28-25-23-17-34(29,30)15-19-8-7-9-20(14-19)16-35(31,32)18-24(25)27(22-12-5-2-6-13-22)33-26(23)21-10-3-1-4-11-21/h1-14H,15-18H2
InChIKey BXKDZOAEXHFMDI-UHFFFAOYSA-N
Mol Weight 506.59 g/mol
Molecular Formula C27H22O6S2
Exact Mass 506.085781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtRdXfvjlos
Name 16,18-Diphenyl-2,11-dithia[3]metacyclo-[3](3,5)-pyranophan-l4-one, 2,2,11,11-tetroxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22O6S2
InChI InChI=1S/C27H22O6S2/c28-25-23-17-34(29,30)15-19-8-7-9-20(14-19)16-35(31,32)18-24(25)27(22-12-5-2-6-13-22)33-26(23)21-10-3-1-4-11-21/h1-14H,15-18H2
InChIKey BXKDZOAEXHFMDI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19933350603
Molecular Weight 506.587 g/mol
SMILES c1c2cc(CS(CC=3C(=O)C(=C(OC3c3ccccc3)c3ccccc3)CS(C2)(=O)=O)(=O)=O)cc1
SPLASH splash10-06vi-3659000000-2be75a0def68888eacb8
Source of Spectrum JF-335-512-12
Synonyms 1(2),1(6)-diphenyl-1(4)H-3,7-dithia-1(3,5)-pyrana-5(1,3)-benzenacyclooctaphan-1(4)-one 3,3,7,7-tetraoxide
Wiley ID 1789802