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CIS-2-(4-CHLOROPHENYL)-2-[2-(1-METHYL-2-IMIDAZOLYL)-ETHYL]-5-(HYDROXYMETHYL)-1,3-OXATHIOLANE
SpectraBase Compound ID 8W8v78XMwhA
InChI InChI=1S/C16H19ClN2O2S/c1-19-9-8-18-15(19)6-7-16(21-14(10-20)11-22-16)12-2-4-13(17)5-3-12/h2-5,8-9,14,20H,6-7,10-11H2,1H3/t14-,16+/m0/s1
InChIKey NMNWFMVUSJEJDF-GOEBONIOSA-N
Mol Weight 338.85 g/mol
Molecular Formula C16H19ClN2O2S
Exact Mass 338.085577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5mV5LhH8uro
Name CIS-2-(4-CHLOROPHENYL)-2-[2-(1-METHYL-2-IMIDAZOLYL)-ETHYL]-5-(HYDROXYMETHYL)-1,3-OXATHIOLANE
Compound Number 24A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H19ClN2O2S
InChI InChI=1S/C16H19ClN2O2S/c1-19-9-8-18-15(19)6-7-16(21-14(10-20)11-22-16)12-2-4-13(17)5-3-12/h2-5,8-9,14,20H,6-7,10-11H2,1H3/t14-,16+/m0/s1
InChIKey NMNWFMVUSJEJDF-GOEBONIOSA-N
Literature Reference Author J.W.KIM,F.S.DAVIS,L.F.HUANG,S.M.ABDELAAL,S.P.UPADHYAYA,J.J.L EE,L.BAUER
Literature Reference Citation J.HETCYCL.CHEM.,33,65(1996)
Literature Reference DOI 10.1002/jhet.5570330112
Molecular Weight 338.852 g/mol
Solvent CDCl3
Source File Reference UWCS20789