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But-2-ynyl 3-oxohexanoate
SpectraBase Compound ID DWqoCKrN6Xm
InChI InChI=1S/C10H14O3/c1-3-5-7-13-10(12)8-9(11)6-4-2/h4,6-8H2,1-2H3
InChIKey GZUKEUSCQAQUDN-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxDV6KLoIZR
Name But-2-ynyl 3-oxohexanoate
Alternate Name(s) 3-ketohexanoic acid but-2-ynyl ester 3-Oxohexanoic acid but-2-ynyl ester But-2-ynyl 3-oxidanylidenehexanoate
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Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-3-5-7-13-10(12)8-9(11)6-4-2/h4,6-8H2,1-2H3
InChIKey GZUKEUSCQAQUDN-UHFFFAOYSA-N
Molecular Weight 182.219 g/mol
SMILES C(CC(CCC)=O)(=O)OCC#CC
SPLASH splash10-0uk9-9000000000-e1ee127a499c42984fbe
Source of Spectrum J-64-1381-3
Wiley ID 1529444