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2-[2-(1-oxo-3-phenylprop-2-ynyl)phenyl]acetic acid methyl ester
SpectraBase Compound ID Lcjn9PreGQi
InChI InChI=1S/C18H14O3/c1-21-18(20)13-15-9-5-6-10-16(15)17(19)12-11-14-7-3-2-4-8-14/h2-10H,13H2,1H3
InChIKey WGRINFCHHZVVGV-UHFFFAOYSA-N
Mol Weight 278.31 g/mol
Molecular Formula C18H14O3
Exact Mass 278.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVevyc5EgZD
Name 2-[2-(1-oxo-3-phenylprop-2-ynyl)phenyl]acetic acid methyl ester
Alternate Name(s) 2-[2-(3-phenylpropioloyl)phenyl]acetic acid methyl ester Methyl 2-[2-(3-phenylprop-2-ynoyl)phenyl]acetate Methyl 2-[2-(3-phenylprop-2-ynoyl)phenyl]ethanoate
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Formula C18H14O3
InChI InChI=1S/C18H14O3/c1-21-18(20)13-15-9-5-6-10-16(15)17(19)12-11-14-7-3-2-4-8-14/h2-10H,13H2,1H3
InChIKey WGRINFCHHZVVGV-UHFFFAOYSA-N
Molecular Weight 278.307 g/mol
SMILES C(#Cc1ccccc1)C(c1c(CC(=O)OC)cccc1)=O
SPLASH splash10-016r-0290000000-f11c8a21e5a72b8ae0ce
Source of Spectrum AT-33-7436-2
Wiley ID 852328