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Methyl (S)-4-cyano-5,5-dimethyl-6-heptynoate

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Methyl (S)-4-cyano-5,5-dimethyl-6-heptynoate
SpectraBase Compound ID 2bL0SxpIAyu
InChI InChI=1S/C11H15NO2/c1-5-11(2,3)9(8-12)6-7-10(13)14-4/h1,9H,6-7H2,2-4H3
InChIKey KHNYRJLXZHHJTO-UHFFFAOYSA-N
Mol Weight 193.25 g/mol
Molecular Formula C11H15NO2
Exact Mass 193.110279 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1MwgfBDwkl
Name Methyl (S)-4-cyano-5,5-dimethyl-6-heptynoate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H15NO2
InChI InChI=1S/C11H15NO2/c1-5-11(2,3)9(8-12)6-7-10(13)14-4/h1,9H,6-7H2,2-4H3
InChIKey KHNYRJLXZHHJTO-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