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4-(4-Chlorophenyl)-5-morpholin-4-yl-thiophen-2-carboxylic acid, ethyl ester

View entire compound with spectra: 1 NMR

4-(4-Chlorophenyl)-5-morpholin-4-yl-thiophen-2-carboxylic acid, ethyl ester
SpectraBase Compound ID 4yQG6p2SYwz
InChI InChI=1S/C17H18ClNO3S/c1-2-22-17(20)15-11-14(12-3-5-13(18)6-4-12)16(23-15)19-7-9-21-10-8-19/h3-6,11H,2,7-10H2,1H3
InChIKey MFHZXKXFDDHHMS-UHFFFAOYSA-N
Mol Weight 351.85 g/mol
Molecular Formula C17H18ClNO3S
Exact Mass 351.069592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4lDHItqzEeB
Name 4-(4-Chlorophenyl)-5-morpholin-4-yl-thiophen-2-carboxylic acid, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 351.069592315 u
Formula C17H18ClNO3S
InChI InChI=1S/C17H18ClNO3S/c1-2-22-17(20)15-11-14(12-3-5-13(18)6-4-12)16(23-15)19-7-9-21-10-8-19/h3-6,11H,2,7-10H2,1H3
InChIKey MFHZXKXFDDHHMS-UHFFFAOYSA-N
Molecular Weight 351.848 g/mol
SMILES C=1(SC(N2CCOCC2)=C(C1)C1=CC=C(C=C1)Cl)C(OCC)=O