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1,5-benzodithiepin-3-one
SpectraBase Compound ID F9Q7Kii6kYJ
InChI InChI=1S/C9H8OS2/c10-7-5-11-8-3-1-2-4-9(8)12-6-7/h1-4H,5-6H2
InChIKey ABMDWNHPWICCJN-UHFFFAOYSA-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 6XhWC5b6pNf
Name 1,5-benzodithiepin-3-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8OS2
InChI InChI=1S/C9H8OS2/c10-7-5-11-8-3-1-2-4-9(8)12-6-7/h1-4H,5-6H2
InChIKey ABMDWNHPWICCJN-UHFFFAOYSA-N
Molecular Weight 196.282 g/mol
SMILES c12SCC(CSc2cccc1)=O
SPLASH splash10-0udj-0900000000-983e5c7794837ebcb12b
Source of Spectrum J-65-3288-2
Wiley ID 1532256