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Decanoic acid, 2,8-bis(methylthio)-9-oxo-, methyl ester
SpectraBase Compound ID A2fhMGbuKT9
InChI InChI=1S/C13H24O3S2/c1-10(14)11(17-3)8-6-5-7-9-12(18-4)13(15)16-2/h11-12H,5-9H2,1-4H3
InChIKey QVFFBUOWSBGDHL-UHFFFAOYSA-N
Mol Weight 292.45 g/mol
Molecular Formula C13H24O3S2
Exact Mass 292.116687 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6q6XTwOXCcB
Name Decanoic acid, 2,8-bis(methylthio)-9-oxo-, methyl ester
Alternate Name(s) Methyl 2,8-bis(methylsulfanyl)-9-oxodecanoate Methyl 2,8-dimethylthio-9-oxodecanaote
CAS Registry Number 60774-84-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O3S2
InChI InChI=1S/C13H24O3S2/c1-10(14)11(17-3)8-6-5-7-9-12(18-4)13(15)16-2/h11-12H,5-9H2,1-4H3
InChIKey QVFFBUOWSBGDHL-UHFFFAOYSA-N
Molecular Weight 292.452 g/mol
SMILES C(=O)(C(SC)CCCCCC(C(=O)C)SC)OC
SPLASH splash10-0r6s-9230000000-c7bcb4fac0cf57267525
Source of Spectrum C-98-4901-0
Wiley ID 1295081