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3-Cyano-2,4,4-trimethyl-2-cyclohexenone
SpectraBase Compound ID J7bycQm2NsM
InChI InChI=1S/C10H13NO/c1-7-8(6-11)10(2,3)5-4-9(7)12/h4-5H2,1-3H3
InChIKey INYFORYUOHLNGE-UHFFFAOYSA-N
Mol Weight 163.22 g/mol
Molecular Formula C10H13NO
Exact Mass 163.099714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2aEviSkXqzp
Name 3-Cyano-2,4,4-trimethyl-2-cyclohexenone
CAS Registry Number 56830-39-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H13NO
InChI InChI=1S/C10H13NO/c1-7-8(6-11)10(2,3)5-4-9(7)12/h4-5H2,1-3H3
InChIKey INYFORYUOHLNGE-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3