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3-endo-tert-Butyl-bicyclo(3.2.1)oct-6-en-8-one

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3-endo-tert-Butyl-bicyclo(3.2.1)oct-6-en-8-one
SpectraBase Compound ID GWCx6Tt4oGk
InChI InChI=1S/C12H18O/c1-12(2,3)10-6-8-4-5-9(7-10)11(8)13/h4-5,8-10H,6-7H2,1-3H3/t8-,9+,10+
InChIKey YERUWCXRPDPWNJ-MYJAWHEDSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DOmFRqOV860
Name 3-exo-tert-Butyl-bicyclo(3.2.1)oct-6-en-8-one
CAS Registry Number 72128-41-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-12(2,3)10-6-8-4-5-9(7-10)11(8)13/h4-5,8-10H,6-7H2,1-3H3/t8-,9+,10+
InChIKey YERUWCXRPDPWNJ-MYJAWHEDSA-N
Instrument Name Bruker HX-90
Literature Reference S. Ayral-Kaloustian, W.C. Agosta, J. Am. Chem. Soc. 102, 314 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3