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5,7-Dimethyl-2-adamantanone

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5,7-Dimethyl-2-adamantanone
SpectraBase Compound ID LbfN18k97sU
InChI InChI=1S/C12H18O/c1-11-3-8-5-12(2,7-11)6-9(4-11)10(8)13/h8-9H,3-7H2,1-2H3/t8-,9?,11-,12?/m0/s1
InChIKey MGUXBQYXBAIDLD-UHFFFAOYSA-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 3AVozHqWTcG
Name 5,7-Dimethyl-2-adamantanone
CAS Registry Number 33670-21-2
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-11-3-8-5-12(2,7-11)6-9(4-11)10(8)13/h8-9H,3-7H2,1-2H3
InChIKey MGUXBQYXBAIDLD-UHFFFAOYSA-N
Instrument Name SF = 090 MHz
Literature Reference J. Org. Chem. 48, 2762 (1983).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3