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S-[(bis(2-methylpropyl)amino)methyl] 2-phenylethanethioate
SpectraBase Compound ID CIh8m5g9rVH
InChI InChI=1S/C17H27NOS/c1-14(2)11-18(12-15(3)4)13-20-17(19)10-16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3
InChIKey IYTBBQUUEQTAMD-UHFFFAOYSA-N
Mol Weight 293.47 g/mol
Molecular Formula C17H27NOS
Exact Mass 293.181336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Go78w9IZVIf
Name S-[(bis(2-methylpropyl)amino)methyl] 2-phenylethanethioate
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H27NOS
InChI InChI=1S/C17H27NOS/c1-14(2)11-18(12-15(3)4)13-20-17(19)10-16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3
InChIKey IYTBBQUUEQTAMD-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 293.467 g/mol
Solvent CDCl3
Source File Reference UWCP1536