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Methyl 3-((3-Chlorophenyl)ethynyl)thiophene-2-carboxylate
SpectraBase Compound ID FoycSIM8XFo
InChI InChI=1S/C14H9ClO2S/c1-17-14(16)13-11(7-8-18-13)6-5-10-3-2-4-12(15)9-10/h2-4,7-9H,1H3
InChIKey FDOPWYKHKLQJDZ-UHFFFAOYSA-N
Mol Weight 276.74 g/mol
Molecular Formula C14H9ClO2S
Exact Mass 276.001178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hxRczH5SVG
Name Methyl 3-((3-Chlorophenyl)ethynyl)thiophene-2-carboxylate
Appearance Yellow solid
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Formula C14H9ClO2S
InChI InChI=1S/C14H9ClO2S/c1-17-14(16)13-11(7-8-18-13)6-5-10-3-2-4-12(15)9-10/h2-4,7-9H,1H3
InChIKey FDOPWYKHKLQJDZ-UHFFFAOYSA-N
Instrument Name GC??MS apparatus
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000468
Molecular Weight 276.737 g/mol
Reported Formula C14H9ClO2S
SMILES COC(=O)c1sccc1C#Cc1cc(ccc1)Cl
SPLASH splash10-004i-0190000000-a0eb7524e6a55def3211
Source of Spectrum U1-2020-3718-3718-1
Wiley ID 1860750