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Prop-2-ynyl 3-oxohexanoate
SpectraBase Compound ID 7JKoLLuuzsw
InChI InChI=1S/C9H12O3/c1-3-5-8(10)7-9(11)12-6-4-2/h2H,3,5-7H2,1H3
InChIKey ICRJJFQDDLPLGB-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lkLmn5Y30v
Name Prop-2-ynyl 3-oxohexanoate
Alternate Name(s) 3-ketohexanoic acid propargyl ester 3-Oxohexanoic acid prop-2-ynyl ester Prop-2-ynyl 3-oxidanylidenehexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-3-5-8(10)7-9(11)12-6-4-2/h2H,3,5-7H2,1H3
InChIKey ICRJJFQDDLPLGB-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C(CC(CCC)=O)(=O)OCC#C
SPLASH splash10-00dr-9000000000-5dedd451bedebea8312c
Source of Spectrum J-64-1381-3
Wiley ID 1529445