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3R-Cyano-cyclohexanone 2R,3R-butanediol acetal
SpectraBase Compound ID F4pNBFIOYlp
InChI InChI=1S/C11H17NO2/c1-8-9(2)14-11(13-8)5-3-4-10(6-11)7-12/h8-10H,3-6H2,1-2H3
InChIKey HQTNQWILFTZDJW-UHFFFAOYSA-N
Mol Weight 195.26 g/mol
Molecular Formula C11H17NO2
Exact Mass 195.125929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2w9REz5eRA
Name 3R-Cyano-cyclohexanone 2R,3R-butanediol acetal
Comments FROM J.J.WILLAERT,BULL.SOC.CHIM.BELG.93,139(1984)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H17NO2
InChI InChI=1S/C11H17NO2/c1-8-9(2)14-11(13-8)5-3-4-10(6-11)7-12/h8-10H,3-6H2,1-2H3
InChIKey HQTNQWILFTZDJW-UHFFFAOYSA-N
Literature Reference J.J. Lemiere, R.A. Domisse, J.A. Lepoivre, J. Am. Chem. Soc. 109, 1363 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported