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p-(2-Thiophenecarboxamido)benzoic acid, 2-(diethylamino)ethyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

p-(2-Thiophenecarboxamido)benzoic acid, 2-(diethylamino)ethyl ester
SpectraBase Compound ID LtdNI50GwsH
InChI InChI=1S/C18H22N2O3S/c1-3-20(4-2)11-12-23-18(22)14-7-9-15(10-8-14)19-17(21)16-6-5-13-24-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,21)
InChIKey OXCGXXXRSQRTRD-UHFFFAOYSA-N
Mol Weight 346.45 g/mol
Molecular Formula C18H22N2O3S
Exact Mass 346.135114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KtIVj8kDTcU
Name p-(2-Thiophenecarboxamido)benzoic acid, 2-(diethylamino)ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 346.135113747 u
Formula C18H22N2O3S
InChI InChI=1S/C18H22N2O3S/c1-3-20(4-2)11-12-23-18(22)14-7-9-15(10-8-14)19-17(21)16-6-5-13-24-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,21)
InChIKey OXCGXXXRSQRTRD-UHFFFAOYSA-N
Molecular Weight 346.445 g/mol
SMILES N(C1=CC=C(C=C1)C(=O)OCCN(CC)CC)C(C1=CC=CS1)=O