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methyl 4-(4-chlorophenyl)-3-thiomorpholin-4-yl-1H-pyrrole-2-carboxylate

View entire compound with spectra: 2 NMR

methyl 4-(4-chlorophenyl)-3-thiomorpholin-4-yl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID 2pyFXNUjSLV
InChI InChI=1S/C16H17ClN2O2S/c1-21-16(20)14-15(19-6-8-22-9-7-19)13(10-18-14)11-2-4-12(17)5-3-11/h2-5,10,18H,6-9H2,1H3
InChIKey QWSFFQKUFIXMCB-UHFFFAOYSA-N
Mol Weight 336.84 g/mol
Molecular Formula C16H17ClN2O2S
Exact Mass 336.069927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CLoe51bR4EC
Name methyl 4-(4-chlorophenyl)-3-thiomorpholin-4-yl-1H-pyrrole-2-carboxylate
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17ClN2O2S
InChI InChI=1S/C16H17ClN2O2S/c1-21-16(20)14-15(19-6-8-22-9-7-19)13(10-18-14)11-2-4-12(17)5-3-11/h2-5,10,18H,6-9H2,1H3
InChIKey QWSFFQKUFIXMCB-UHFFFAOYSA-N
Literature Reference Author A.ROLFS,C.MUEGGE,J.LIEBSCHER
Literature Reference Citation MAGN.RES.CHEM.,32,782(1994)
Literature Reference DOI 10.1002/mrc.1260321212
Molecular Weight 336.836 g/mol
Solvent CDCl3
Source File Reference UWGE1072