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4-ACETOXY-1-(2-ETHOXYETHYL)-4-[3-(PARA-METHYLPHENOXY)-1-PROPYNYL]-PIPERIDINE-HYDROCHLORIDE;CONFORMER-A
SpectraBase Compound ID 8lBoZTJV4WN
InChI InChI=1S/C21H29NO4.ClH/c1-4-24-17-15-22-13-11-21(12-14-22,26-19(3)23)10-5-16-25-20-8-6-18(2)7-9-20;/h6-9H,4,11-17H2,1-3H3;1H
InChIKey NOCLEYWWUBBEMM-UHFFFAOYSA-N
Mol Weight 395.93 g/mol
Molecular Formula C21H30ClNO4
Exact Mass 395.186336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A1uJtYMYlpQ
Name 4-ACETOXY-1-(2-ETHOXYETHYL)-4-[3-(PARA-METHYLPHENOXY)-1-PROPYNYL]-PIPERIDINE-HYDROCHLORIDE
Compound Number IIIB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30ClNO4
InChI InChI=1S/C21H29NO4.ClH/c1-4-24-17-15-22-13-11-21(12-14-22,26-19(3)23)10-5-16-25-20-8-6-18(2)7-9-20;/h6-9H,4,11-17H2,1-3H3;1H
InChIKey NOCLEYWWUBBEMM-UHFFFAOYSA-N
Literature Reference Author I.A.POPLAVSKAYA,K.B.BAZHYKOVA,K.D.PRALIEV
Literature Reference Citation RUSS.J.ORG.CHEM.,37,1782(2001)
Literature Reference DOI 10.1023/A:1013999212842
Molecular Weight 395.927 g/mol
Solvent CD3OD
Source File Reference UWVN5744