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2-diethylamino-2-phenyl-ethanethioic acid S-(benzyl) ester
SpectraBase Compound ID HiKmybu9Ziu
InChI InChI=1S/C19H23NOS/c1-3-20(4-2)18(17-13-9-6-10-14-17)19(21)22-15-16-11-7-5-8-12-16/h5-14,18H,3-4,15H2,1-2H3
InChIKey LTEMJBKGCMRCEA-UHFFFAOYSA-N
Mol Weight 313.46 g/mol
Molecular Formula C19H23NOS
Exact Mass 313.150036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E03oXEPqizY
Name 2-diethylamino-2-phenyl-ethanethioic acid S-(benzyl) ester
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23NOS
InChI InChI=1S/C19H23NOS/c1-3-20(4-2)18(17-13-9-6-10-14-17)19(21)22-15-16-11-7-5-8-12-16/h5-14,18H,3-4,15H2,1-2H3
InChIKey LTEMJBKGCMRCEA-UHFFFAOYSA-N
Literature Reference Author K.KHUMTAVEEPORN,H.ALPER
Literature Reference Citation J.ORG.CHEM.,59,1414(1994)
Literature Reference DOI 10.1021/jo00085a034
Molecular Weight 313.458 g/mol
Solvent CDCl3
Source File Reference UWCP1541