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XFMQGQAAHOGFQS-UHFFFAOYSA-N
SpectraBase Compound ID FB9NvPpEUE2
InChI InChI=1S/C5H8O3S/c6-5-1-3-9(7,8)4-2-5/h1-4H2
InChIKey XFMQGQAAHOGFQS-UHFFFAOYSA-N
Mol Weight 148.18 g/mol
Molecular Formula C5H8O3S
Exact Mass 148.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94nc8nspEfG
Name 4H-Thiopyran-4-one, tetrahydro-, 1,1-dioxide
CAS Registry Number 17396-35-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O3S
InChI InChI=1S/C5H8O3S/c6-5-1-3-9(7,8)4-2-5/h1-4H2
InChIKey XFMQGQAAHOGFQS-UHFFFAOYSA-N
Molecular Weight 148.176 g/mol
SMILES C1S(=O)(=O)CCC(C1)=O
SPLASH splash10-0a4i-9100000000-ba363167a17a50919470
Source of Spectrum EP-5639-0-0
Synonyms Tetrahydro-4H-thiopyran-4-one 1,1-dioxide 1,1-bis(oxidanylidene)thian-4-one 1,1-Diketothian-4-one 1,1-Dioxo-4-thianone 1,1-Dioxothian-4-one 4-Thiacyclohexanone dioxide Tetrahydrothiopyran-4-one S,S-dioxide
Wiley ID 1145111