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3,3,7,7-Tetramethyl-cycloheptane-1,2-dione
SpectraBase Compound ID DyULyFwyNUv
InChI InChI=1S/C11H18O2/c1-10(2)6-5-7-11(3,4)9(13)8(10)12/h5-7H2,1-4H3
InChIKey PAJBOHCBHXDLOU-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H3Eh1EDsCUn
Name 3,3,7,7-Tetramethyl-cycloheptane-1,2-dione
CAS Registry Number 68347-39-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-10(2)6-5-7-11(3,4)9(13)8(10)12/h5-7H2,1-4H3
InChIKey PAJBOHCBHXDLOU-UHFFFAOYSA-N
Literature Reference W. Ando, Y. Kabe, J. Chem. Soc. Chem. Comm. 741 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3