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sec-butyl acetothioacetate
SpectraBase Compound ID 1YrVwK1woqj
InChI InChI=1S/C8H14O2S/c1-4-7(3)10-8(11)5-6(2)9/h7H,4-5H2,1-3H3
InChIKey FOAPGQVJVKPMOQ-UHFFFAOYSA-N
Mol Weight 174.26 g/mol
Molecular Formula C8H14O2S
Exact Mass 174.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NvRHktdTN9
Name sec-butyl acetothioacetate
Alternate Name(s) O-sec-butyl 3-oxobutanethioate 3-Oxobutanethioic acid O-butan-2-yl ester O-butan-2-yl 3-oxobutanethioate O-butan-2-yl 3-oxidanylidenebutanethioate
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Formula C8H14O2S
InChI InChI=1S/C8H14O2S/c1-4-7(3)10-8(11)5-6(2)9/h7H,4-5H2,1-3H3
InChIKey FOAPGQVJVKPMOQ-UHFFFAOYSA-N
Molecular Weight 174.258 g/mol
SMILES C(CC(=O)C)(OC(CC)C)=S
SPLASH splash10-000l-9000000000-2a562385c3c4baaddc4a
Source of Spectrum JX-2015-6-5590
Wiley ID 1729168