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1,2-Dithiane-4-carboxylic acid
SpectraBase Compound ID G8xKcBaaN0V
InChI InChI=1S/C5H8O2S2/c6-5(7)4-1-2-8-9-3-4/h4H,1-3H2,(H,6,7)
InChIKey YOKHUQHEMRAAMT-UHFFFAOYSA-N
Mol Weight 164.24 g/mol
Molecular Formula C5H8O2S2
Exact Mass 163.996572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QlpsXO6or9
Name 1,2-Dithiane-4-carboxylic acid
CAS Registry Number 14091-99-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O2S2
InChI InChI=1S/C5H8O2S2/c6-5(7)4-1-2-8-9-3-4/h4H,1-3H2,(H,6,7)
InChIKey YOKHUQHEMRAAMT-UHFFFAOYSA-N
Molecular Weight 164.237 g/mol
SMILES OC(=O)C1CCSSC1
SPLASH splash10-01q0-9400000000-dc7efd76da25cc0be68c
Source of Spectrum T-66-117-0
Synonyms 4-Dithianecarboxylic acid dithiane-4-carboxylic acid o-Dithiane-4-carboxylic acid
Wiley ID 13603