For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
METHYL-3-AMINO-4-(2-CHLOROETHYL)-5-PYRROLIDINO-2-THIOPHENECARBOXYLATE
SpectraBase Compound ID LfFQxUKgZ4r
InChI InChI=1S/C12H17ClN2O2S/c1-17-12(16)10-9(14)8(4-5-13)11(18-10)15-6-2-3-7-15/h2-7,14H2,1H3
InChIKey UTBFQTQGHADDEM-UHFFFAOYSA-N
Mol Weight 288.79 g/mol
Molecular Formula C12H17ClN2O2S
Exact Mass 288.069927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID He4eJU6wRUD
Name METHYL-3-AMINO-4-(2-CHLOROETHYL)-5-PYRROLIDINO-2-THIOPHENECARBOXYLATE
Compound Number 6F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17ClN2O2S
InChI InChI=1S/C12H17ClN2O2S/c1-17-12(16)10-9(14)8(4-5-13)11(18-10)15-6-2-3-7-15/h2-7,14H2,1H3
InChIKey UTBFQTQGHADDEM-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 288.792 g/mol
Sample ID 53146
Solvent DMSO-D6