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TRANS-1-(BENZYLAMINOMETHYL)-CYCLOHEXANE-1,2-DIOL-HYDROCHLORIDE
SpectraBase Compound ID J9DOnIzJung
InChI InChI=1S/C14H21NO2.ClH/c16-13-8-4-5-9-14(13,17)11-15-10-12-6-2-1-3-7-12;/h1-3,6-7,13,15-17H,4-5,8-11H2;1H/t13-,14+;/m0./s1
InChIKey ITWMDJFGIQWDBO-LMRHVHIWSA-N
Mol Weight 271.79 g/mol
Molecular Formula C14H22ClNO2
Exact Mass 271.133907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CqCHEvxgwKh
Name TRANS-1-(BENZYLAMINOMETHYL)-CYCLOHEXANE-1,2-DIOL-HYDROCHLORIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22ClNO2
InChI InChI=1S/C14H21NO2.ClH/c16-13-8-4-5-9-14(13,17)11-15-10-12-6-2-1-3-7-12;/h1-3,6-7,13,15-17H,4-5,8-11H2;1H/t13-,14+;/m0./s1
InChIKey ITWMDJFGIQWDBO-LMRHVHIWSA-N
Literature Reference Author A.HETENYI,Z.SZAKONYI,K.D.KLIKA,K.PIHLAJA,F.FUELOEP
Literature Reference Citation J.ORG.CHEM.,68,2175(2003)
Literature Reference DOI 10.1021/jo026428t
Molecular Weight 271.787 g/mol
Solvent DMSO-D6
Source File Reference UWLU27918