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3-[3-(3-ethoxy-3-keto-prop-1-ynyl)phenyl]propiolic acid ethyl ester
SpectraBase Compound ID L7o2EZXrmTv
InChI InChI=1S/C16H14O4/c1-3-19-15(17)10-8-13-6-5-7-14(12-13)9-11-16(18)20-4-2/h5-7,12H,3-4H2,1-2H3
InChIKey RZFLPKWJWSIJBL-UHFFFAOYSA-N
Mol Weight 270.28 g/mol
Molecular Formula C16H14O4
Exact Mass 270.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1llJVPNyYJR
Name 3-[3-(3-ethoxy-3-keto-prop-1-ynyl)phenyl]propiolic acid ethyl ester
Alternate Name(s) 3-[3-(3-ethoxy-3-oxoprop-1-ynyl)phenyl]-2-propynoic acid ethyl ester Ethyl 3-[3-(3-ethoxy-3-oxidanylidene-prop-1-ynyl)phenyl]prop-2-ynoate Ethyl 3-[3-(3-ethoxy-3-oxo-prop-1-ynyl)phenyl]prop-2-ynoate
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Formula C16H14O4
InChI InChI=1S/C16H14O4/c1-3-19-15(17)10-8-13-6-5-7-14(12-13)9-11-16(18)20-4-2/h5-7,12H,3-4H2,1-2H3
InChIKey RZFLPKWJWSIJBL-UHFFFAOYSA-N
Molecular Weight 270.284 g/mol
SMILES C(#Cc1cc(C#CC(=O)OCC)ccc1)C(=O)OCC
SPLASH splash10-004i-0950000000-4e3ba268e4304919e86e
Source of Spectrum F-55-11049-0
Wiley ID 839135