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3,5-Dimethyl-5-(ethylthio)-2(5H)-furanone
SpectraBase Compound ID KsoPWbUc8wJ
InChI InChI=1S/C8H12O2S/c1-4-11-8(3)5-6(2)7(9)10-8/h5H,4H2,1-3H3
InChIKey DWTLLQJEFUPIQC-UHFFFAOYSA-N
Mol Weight 172.24 g/mol
Molecular Formula C8H12O2S
Exact Mass 172.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GtXbdVBHl6
Name 3,5-Dimethyl-5-(ethylthio)-2(5H)-furanone
Alternate Name(s) 5-(ethylsulfanyl)-3,5-dimethyl-2(5H)-furanone
Comments Less than 3 mono-isotopic peaks
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Formula C8H12O2S
InChI InChI=1S/C8H12O2S/c1-4-11-8(3)5-6(2)7(9)10-8/h5H,4H2,1-3H3
InChIKey DWTLLQJEFUPIQC-UHFFFAOYSA-N
Molecular Weight 172.242 g/mol
SMILES C1(OC(C=C1C)(SCC)C)=O
SPLASH splash10-03di-0900000000-feb94b4a9d27ee869f38
Source of Spectrum Y4-91-78-6
Wiley ID 1550422