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trans-4-Acetyl-3-(1-cyano-1-methyl-ethyl)-1-cyclohexene

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trans-4-Acetyl-3-(1-cyano-1-methyl-ethyl)-1-cyclohexene
SpectraBase Compound ID LZquYFfFDzB
InChI InChI=1S/C12H17NO/c1-9(14)10-6-4-5-7-11(10)12(2,3)8-13/h5,7,10-11H,4,6H2,1-3H3
InChIKey ZOQKHBDSGCXVRD-UHFFFAOYSA-N
Mol Weight 191.27 g/mol
Molecular Formula C12H17NO
Exact Mass 191.131014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2l62xwCh9Lv
Name trans-4-Acetyl-3-(1-cyano-1-methyl-ethyl)-1-cyclohexene
CAS Registry Number 85251-14-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H17NO
InChI InChI=1S/C12H17NO/c1-9(14)10-6-4-5-7-11(10)12(2,3)8-13/h5,7,10-11H,4,6H2,1-3H3
InChIKey ZOQKHBDSGCXVRD-UHFFFAOYSA-N
Literature Reference M.F. Semmelhack, J.W. Herdon, J. Springer, J. Am. Chem. Soc. 105, 2497 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3