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1-Benzyl-4-hydroxyisonipecotonitrile hydrochloride

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1-Benzyl-4-hydroxyisonipecotonitrile hydrochloride
SpectraBase Compound ID 5LVXQonUsMF
InChI InChI=1S/C13H16N2O.ClH/c14-11-13(16)6-8-15(9-7-13)10-12-4-2-1-3-5-12;/h1-5,16H,6-10H2;1H
InChIKey BFCODNKBFLYVOU-UHFFFAOYSA-N
Mol Weight 252.74 g/mol
Molecular Formula C13H17ClN2O
Exact Mass 252.102941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3RIv7vQzI8
Name 1-BENZYL-4-HYDROXYISONIPECOTONITRILE, HYDROCHLORIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O HCl
InChI InChI=1S/C13H16N2O.ClH/c14-11-13(16)6-8-15(9-7-13)10-12-4-2-1-3-5-12;/h1-5,16H,6-10H2;1H
InChIKey BFCODNKBFLYVOU-UHFFFAOYSA-N
Molecular Weight 252.75
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms ISONIPECOTONITRILE, 1-BENZYL-4-HYDROXY-, HYDROCHLORIDE