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ethyl 2-(thiophene-2-carbonyl)benzoate
SpectraBase Compound ID DKv2i1u09kp
InChI InChI=1S/C14H12O3S/c1-2-17-14(16)11-7-4-3-6-10(11)13(15)12-8-5-9-18-12/h3-9H,2H2,1H3
InChIKey YFAXYGOCHJVRPX-UHFFFAOYSA-N
Mol Weight 260.31 g/mol
Molecular Formula C14H12O3S
Exact Mass 260.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzSV5wi8rsO
Name ethyl 2-(thiophene-2-carbonyl)benzoate
Appearance Pale yellow solid
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Exact Mass 260.050715417 u
Formula C14H12O3S
InChI InChI=1S/C14H12O3S/c1-2-17-14(16)11-7-4-3-6-10(11)13(15)12-8-5-9-18-12/h3-9H,2H2,1H3
InChIKey YFAXYGOCHJVRPX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201605139
Molecular Weight 260.307 g/mol
Quality 176
Reported Formula C14H12O3S
SMILES C(C)OC(C1=C(C=CC=C1)C(=O)C=1SC=CC1)=O
SPLASH splash10-03xr-0690000000-6dd61ff805fc728641e9
Source of Spectrum QE-23-SM26-7a (DOI: 10.1002/chem.201605139)
Thin-Layer Chromatography 0.29 (SiO2, i-hexane/EtOAc, 9:1)
Wiley ID 1903813