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(4R,5S)-5-Cyanomethyl-5-methyl-6-oxo-4-vinyl-heptanenitrile

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(4R,5S)-5-Cyanomethyl-5-methyl-6-oxo-4-vinyl-heptanenitrile
SpectraBase Compound ID 5UTllOoUkG5
InChI InChI=1S/C12H16N2O/c1-4-11(6-5-8-13)12(3,7-9-14)10(2)15/h4,11H,1,5-7H2,2-3H3
InChIKey GKCPFUKYUPWGMA-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C12H16N2O
Exact Mass 204.126263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CbGNGlJW7uv
Name (4R,5S)-5-Cyanomethyl-5-methyl-6-oxo-4-vinyl-heptanenitrile
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16N2O
InChI InChI=1S/C12H16N2O/c1-4-11(6-5-8-13)12(3,7-9-14)10(2)15/h4,11H,1,5-7H2,2-3H3
InChIKey GKCPFUKYUPWGMA-UHFFFAOYSA-N
Instrument Name Bruker WP-200
Literature Reference R.V. Stevens, N. Beaulieu, W.H.Chan, J. Am. Chem. Soc. 108, 1039 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3