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6-ketohex-2-ynoic acid methyl ester
SpectraBase Compound ID 5OZQLYvFEsk
InChI InChI=1S/C7H8O3/c1-10-7(9)5-3-2-4-6-8/h6H,2,4H2,1H3
InChIKey JRXXEUZUAXNTFJ-UHFFFAOYSA-N
Mol Weight 140.14 g/mol
Molecular Formula C7H8O3
Exact Mass 140.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LKcB0QQNLv
Name 6-ketohex-2-ynoic acid methyl ester
Alternate Name(s) 6-Oxo-2-hexynoic acid methyl ester Methyl 6-oxidanylidenehex-2-ynoate Methyl 6-oxohex-2-ynoate
CAS Registry Number 79975-90-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O3
InChI InChI=1S/C7H8O3/c1-10-7(9)5-3-2-4-6-8/h6H,2,4H2,1H3
InChIKey JRXXEUZUAXNTFJ-UHFFFAOYSA-N
Molecular Weight 140.138 g/mol
SMILES C(#CCCC=O)C(=O)OC
SPLASH splash10-00dl-9100000000-99aa91a22f882a56e9e6
Source of Spectrum C-103-7568-0
Wiley ID 1139080