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5-hydroxy-2,2,5,6,6-pentamethyl-3-heptanone
SpectraBase Compound ID 1O9UB5Ip6NU
InChI InChI=1S/C12H24O2/c1-10(2,3)9(13)8-12(7,14)11(4,5)6/h14H,8H2,1-7H3
InChIKey MVXQRCHYGBJBMO-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3RUWISZmyhX
Name 2,2,5,6,6-Pentamethyl-5-hydroxy-heptanone-3
CAS Registry Number 3205-30-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-10(2,3)9(13)8-12(7,14)11(4,5)6/h14H,8H2,1-7H3
InChIKey MVXQRCHYGBJBMO-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference H.O. House, M.J. Lusch, J. Org. Chem. 42, 183 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3