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5,7-Di-tert-butyl-1-cyano-1-methyl-spiro(2.5)octa-4,7-dien-6-one

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5,7-Di-tert-butyl-1-cyano-1-methyl-spiro(2.5)octa-4,7-dien-6-one
SpectraBase Compound ID 6cvUcoKbTGz
InChI InChI=1S/C18H25NO/c1-15(2,3)12-8-18(10-17(18,7)11-19)9-13(14(12)20)16(4,5)6/h8-9H,10H2,1-7H3
InChIKey CAEXBSCHUJXQFP-UHFFFAOYSA-N
Mol Weight 271.4 g/mol
Molecular Formula C18H25NO
Exact Mass 271.193614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LrNd1mkdjx7
Name 5,7-Di-tert-butyl-1-cyano-1-methyl-spiro(2.5)octa-4,7-dien-6-one
CAS Registry Number 82065-50-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H25NO
InChI InChI=1S/C18H25NO/c1-15(2,3)12-8-18(10-17(18,7)11-19)9-13(14(12)20)16(4,5)6/h8-9H,10H2,1-7H3
InChIKey CAEXBSCHUJXQFP-UHFFFAOYSA-N
Literature Reference A.S. Kende, P. Hebeisen, P.J. Sanfilippo, J. Am. Chem. Soc. 104, 4244 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3