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2,7-Dithiabicyclo[2.2.1]heptane-3,5-dione, 6,6-dimethyl-1,4-diphenyl-
SpectraBase Compound ID HwOayZuWXmN
InChI InChI=1S/C19H16O2S2/c1-17(2)15(20)18(13-9-5-3-6-10-13)16(21)22-19(17,23-18)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey MDQPKRDZZHQUPG-UHFFFAOYSA-N
Mol Weight 340.46 g/mol
Molecular Formula C19H16O2S2
Exact Mass 340.059172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoJzS7opLmO
Name 2,7-Dithiabicyclo[2.2.1]heptane-3,5-dione, 6,6-dimethyl-1,4-diphenyl-
CAS Registry Number 100094-95-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O2S2
InChI InChI=1S/C19H16O2S2/c1-17(2)15(20)18(13-9-5-3-6-10-13)16(21)22-19(17,23-18)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey MDQPKRDZZHQUPG-UHFFFAOYSA-N
Molecular Weight 340.455 g/mol
SMILES C12(C(C(=O)C(S2)(c2ccccc2)C(S1)=O)(C)C)c1ccccc1
SPLASH splash10-05cu-2910000000-9eb625648c21616575ad
Source of Spectrum K-118-3461-9
Synonyms 6,6-Dimethyl-1,4-diphenyl-2,7-dithiabicyclo[2.2.1]heptan-3,5-dion 6,6-Dimethyl-1,4-diphenyl-2,7-dithiabicyclo[2.2.1]heptane-3,5-dione
Wiley ID 1335110