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1-Hydroxy-1-phenyl-2,2-trimethylene-heptan-3-one

View entire compound with spectra: 1 NMR, and 2 MS (GC)

1-Hydroxy-1-phenyl-2,2-trimethylene-heptan-3-one
SpectraBase Compound ID 44BMj4N0IN6
InChI InChI=1S/C16H22O2/c1-2-3-10-14(17)16(11-7-12-16)15(18)13-8-5-4-6-9-13/h4-6,8-9,15,18H,2-3,7,10-12H2,1H3
InChIKey RIJLBPXWVIRBEP-UHFFFAOYSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID InlnYMDW4Oh
Name 1-Hydroxy-1-phenyl-2,2-trimethylene-heptan-3-one
CAS Registry Number 97234-41-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-2-3-10-14(17)16(11-7-12-16)15(18)13-8-5-4-6-9-13/h4-6,8-9,15,18H,2-3,7,10-12H2,1H3
InChIKey RIJLBPXWVIRBEP-UHFFFAOYSA-N
Literature Reference R. Haener, T. Laube, D. Seebach, J. Am. Chem. Soc. 107, 5396 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3