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4,8,8-Trimethyl-1,3,6-cyclononatriene

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4,8,8-Trimethyl-1,3,6-cyclononatriene
SpectraBase Compound ID LHcci5oigDe
InChI InChI=1S/C12H18/c1-11-7-5-4-6-9-12(2,3)10-8-11/h4-8,10-11H,9H2,1-3H3/b6-4?,7-5-,10-8-
InChIKey HMKFDQUISBYGRX-GVBYZTDFSA-N
Mol Weight 162.28 g/mol
Molecular Formula C12H18
Exact Mass 162.140851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 42IeWGX5tRw
Name 4,8,8-Trimethyl-1,3,6-cyclononatriene
CAS Registry Number 61244-36-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18
InChI InChI=1S/C12H18/c1-11-7-5-4-6-9-12(2,3)10-8-11/h4-8,10-11H,9H2,1-3H3/b6-4?,7-5-,10-8-
InChIKey HMKFDQUISBYGRX-GVBYZTDFSA-N
Instrument Name Bruker HX-90
Literature Reference L.A. Paquette, S.V. Ley, S.G. Traynor, J. Am. Chem. Soc. 98, 8162 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3