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(3S)-4,4,4-trichloro-N,3-dimethyl-N-[(1S,3S)-4,4,4-trichloro-3-methyl-1-methylol-butyl]butyramide
SpectraBase Compound ID LceLofJO1cp
InChI InChI=1S/C12H19Cl6NO2/c1-7(11(13,14)15)4-9(6-20)19(3)10(21)5-8(2)12(16,17)18/h7-9,20H,4-6H2,1-3H3/t7-,8-,9-/m0/s1
InChIKey VJZCDILODIBJFB-CIUDSAMLSA-N
Mol Weight 422.0 g/mol
Molecular Formula C12H19Cl6NO2
Exact Mass 418.954695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AwVnSbDaDXI
Name (3S)-4,4,4-trichloro-N,3-dimethyl-N-[(1S,3S)-4,4,4-trichloro-3-methyl-1-methylol-butyl]butyramide
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H19Cl6NO2
InChI InChI=1S/C12H19Cl6NO2/c1-7(11(13,14)15)4-9(6-20)19(3)10(21)5-8(2)12(16,17)18/h7-9,20H,4-6H2,1-3H3/t7-,8-,9-/m0/s1
InChIKey VJZCDILODIBJFB-CIUDSAMLSA-N
Literature Reference Author M.D.UNSON,C.B.ROSE,D.J.FAULKNER,L.S.BRINEN,J.R.STEINER,J.CLA RDY
Literature Reference Citation J.ORG.CHEM.,58,6336(1993)
Literature Reference DOI 10.1021/jo00075a029
Molecular Weight 422.006 g/mol
Solvent CDCl3
Source File Reference UWGE2250