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cis-9,11- Dithiabicyclo[6.3.0]undeca-2,4,6-triene-10-one
SpectraBase Compound ID 9czRlozxOx
InChI InChI=1S/C9H8OS2/c10-9-11-7-5-3-1-2-4-6-8(7)12-9/h1-8H/b2-1-,5-3-,6-4-/t7-,8+
InChIKey KERJREFZWCEAGB-JGASFXGPSA-N
Mol Weight 196.28 g/mol
Molecular Formula C9H8OS2
Exact Mass 196.001657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KOwK0bM0b20
Name cis-9,11- Dithiabicyclo[6.3.0]undeca-2,4,6-triene-10-one
Alternate Name(s) (3aR,4Z,6Z,8Z,9aS)-3a,9a-dihydrocycloocta[d][1,3]dithiol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8OS2
InChI InChI=1S/C9H8OS2/c10-9-11-7-5-3-1-2-4-6-8(7)12-9/h1-8H/b2-1-,5-3-,6-4-/t7-,8+
InChIKey KERJREFZWCEAGB-JGASFXGPSA-N
Literature Reference DOI 10.1002/prac.199733901105
Molecular Weight 196.282 g/mol
SMILES [C@@]12(\C=C/C=C\C=C/[C@@]2(SC(S1)=O)[H])[H]
SPLASH splash10-0006-9500000000-f25c275ed44027ce2014
Source of Spectrum JF-339-592-11
Wiley ID 1768263