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3E,4A-DIHYDROXY-1,3E-DIMETHYL-2E-(4-CHLOROPHENYL)-4E-CYANOPIPERIDINE
SpectraBase Compound ID 7WGGhT1NEup
InChI InChI=1S/C14H17ClN2O2/c1-13(18)9-17(2)12(7-14(13,19)8-16)10-3-5-11(15)6-4-10/h3-6,12,18-19H,7,9H2,1-2H3/t12-,13-,14-/m0/s1
InChIKey LPJGBHDHYRMGJV-IHRRRGAJSA-N
Mol Weight 280.75 g/mol
Molecular Formula C14H17ClN2O2
Exact Mass 280.097855 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7iEBEAvZSzo
Name 3E,4A-DIHYDROXY-1,3E-DIMETHYL-2E-(4-CHLOROPHENYL)-4E-CYANOPIPERIDINE
Compound Number IV
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17ClN2O2
InChI InChI=1S/C14H17ClN2O2/c1-13(18)9-17(2)12(7-14(13,19)8-16)10-3-5-11(15)6-4-10/h3-6,12,18-19H,7,9H2,1-2H3/t12-,13-,14-/m0/s1
InChIKey LPJGBHDHYRMGJV-IHRRRGAJSA-N
Literature Reference Author F.F.LAKHVICH,N.B.KHRIPACH,L.S.STANISHEVSKII
Literature Reference Citation CHEM.HET.COMP.,29,575(1993)
Literature Reference DOI 10.1007/bf00534472
Molecular Weight 280.754 g/mol
Solvent DMSO-D6_OR_CD3OD
Source File Reference UWMZ12556