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4-[(E)-3-keto-3-methoxy-prop-1-enoxy]hept-2-ynoic acid methyl ester
SpectraBase Compound ID EPfZOUry81b
InChI InChI=1S/C12H16O5/c1-4-5-10(6-7-11(13)15-2)17-9-8-12(14)16-3/h8-10H,4-5H2,1-3H3/b9-8+
InChIKey WPARPRXWCLJCIE-CMDGGOBGSA-N
Mol Weight 240.25 g/mol
Molecular Formula C12H16O5
Exact Mass 240.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmLd80npLsi
Name 4-[(E)-3-keto-3-methoxy-prop-1-enoxy]hept-2-ynoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O5
InChI InChI=1S/C12H16O5/c1-4-5-10(6-7-11(13)15-2)17-9-8-12(14)16-3/h8-10H,4-5H2,1-3H3/b9-8+
InChIKey WPARPRXWCLJCIE-CMDGGOBGSA-N
Molecular Weight 240.255 g/mol
SMILES C(#CC(O\C=C\C(=O)OC)CCC)C(=O)OC
SPLASH splash10-000i-1900000000-ef9904459ce78bb0382d
Source of Spectrum OL-2001-1907-3
Synonyms 4-[(E)-3-methoxy-3-oxoprop-1-enoxy]-2-heptynoic acid methyl ester Methyl 4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enoxy]hept-2-ynoate Methyl 4-[(E)-3-methoxy-3-oxo-prop-1-enoxy]hept-2-ynoate
Wiley ID 850165