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5,9,9-Trimethyl-1,3,6-cyclononatriene

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5,9,9-Trimethyl-1,3,6-cyclononatriene
SpectraBase Compound ID 4jNHRhapGo8
InChI InChI=1S/C12H18/c1-11-7-4-5-9-12(2,3)10-6-8-11/h4-9,11H,10H2,1-3H3/b7-4-,8-6-,9-5?
InChIKey RKDVUKLZLKMNKM-WALPKTMVSA-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 CydhoBTXPT7
Name 5,9,9-Trimethyl-1,3,6-cyclononatriene
CAS Registry Number 61244-35-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18
InChI InChI=1S/C12H18/c1-11-7-4-5-9-12(2,3)10-6-8-11/h4-9,11H,10H2,1-3H3/b7-4-,8-6-,9-5?
InChIKey RKDVUKLZLKMNKM-WALPKTMVSA-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