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METHYL-3-AMINO-4-(2-CHLOROETHYL)-5-MORPHOLINO-2-THIOPHENECARBOXYLATE
SpectraBase Compound ID IGiDgnCcB0l
InChI InChI=1S/C12H17ClN2O3S/c1-17-12(16)10-9(14)8(2-3-13)11(19-10)15-4-6-18-7-5-15/h2-7,14H2,1H3
InChIKey NJRQTVKQLFSMPP-UHFFFAOYSA-N
Mol Weight 304.79 g/mol
Molecular Formula C12H17ClN2O3S
Exact Mass 304.064841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWExoUu4dvX
Name METHYL-3-AMINO-4-(2-CHLOROETHYL)-5-MORPHOLINO-2-THIOPHENECARBOXYLATE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17ClN2O3S
InChI InChI=1S/C12H17ClN2O3S/c1-17-12(16)10-9(14)8(2-3-13)11(19-10)15-4-6-18-7-5-15/h2-7,14H2,1H3
InChIKey NJRQTVKQLFSMPP-UHFFFAOYSA-N
Literature Reference Author H.MARUOKA,K.YAMAGATA,F.OKABE,Y.TOMIOKA
Literature Reference Citation J.HETCYCL.CHEM.,42,717(2005)
Literature Reference DOI 10.1002/jhet.5570420438
Molecular Weight 304.792 g/mol
Sample ID 53144
Solvent DMSO-D6