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1,3-Dithiepan-5-one

View entire compound with spectra: 2 MS (GC)

1,3-Dithiepan-5-one
SpectraBase Compound ID EgcSOBCpvoE
InChI InChI=1S/C5H8OS2/c6-5-1-2-7-4-8-3-5/h1-4H2
InChIKey WRVMRTYRRYZPSN-UHFFFAOYSA-N
Mol Weight 148.24 g/mol
Molecular Formula C5H8OS2
Exact Mass 148.001657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AoYh8RbuFD
Name 1,3-Dithiepan-5-one
Classification Dithioacetals
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 148.001657225 u
Formula C5H8OS2
InChI InChI=1S/C5H8OS2/c6-5-1-2-7-4-8-3-5/h1-4H2
InChIKey WRVMRTYRRYZPSN-UHFFFAOYSA-N
Molecular Weight 148.238 g/mol
Number of Peaks 17
SMILES C1SCCC(CS1)=O
SPLASH splash10-03di-9500000000-1577e1c1a7545642ac7c
Source of Spectrum FF-13-182-10 (DOI: 10.1002_(SICI)1099-1026(199805_06)13_3_177)
Wiley ID 1775164