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Methyl 3-(((methylsulphonyl)thio)acetyl)propanoate
SpectraBase Compound ID Ci8JcoKAg6H
InChI InChI=1S/C7H12O5S2/c1-12-7(9)4-3-6(8)5-13-14(2,10)11/h3-5H2,1-2H3
InChIKey DIHMONGYTWVWGV-UHFFFAOYSA-N
Mol Weight 240.29 g/mol
Molecular Formula C7H12O5S2
Exact Mass 240.012616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1aOmM9FSt5v
Name Methyl 3-(((methylsulphonyl)thio)acetyl)propanoate
Alternate Name(s) Methyl 5-{[methyl(dioxido)sulfanyl]sulfanyl}-4-oxopentanoate
CAS Registry Number 76078-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O5S2
InChI InChI=1S/C7H12O5S2/c1-12-7(9)4-3-6(8)5-13-14(2,10)11/h3-5H2,1-2H3
InChIKey DIHMONGYTWVWGV-UHFFFAOYSA-N
Molecular Weight 240.288 g/mol
SMILES C(SS(=O)(=O)C)C(=O)CCC(=O)OC
SPLASH splash10-00li-9300000000-f8ae1c3859a96a54ccdd
Source of Spectrum W5-1989-24683-1
Wiley ID 1242295