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5-Oxo-5,6,6a,7,12,12a-hexahydro-benz(A)anthracene
SpectraBase Compound ID EkJmFXzujB9
InChI InChI=1S/C18H16O/c19-18-11-14-9-12-5-1-2-6-13(12)10-17(14)15-7-3-4-8-16(15)18/h1-8,14,17H,9-11H2
InChIKey JWPDJFWGZRIDQX-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C18H16O
Exact Mass 248.120115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ATEQjB158Kf
Name 5-Oxo-5,6,6a,7,12,12a-hexahydro-benz(A)anthracene
Comments 13C LABELLED AT C5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H16O
InChI InChI=1S/C18H16O/c19-18-11-14-9-12-5-1-2-6-13(12)10-17(14)15-7-3-4-8-16(15)18/h1-8,14,17H,9-11H2
InChIKey JWPDJFWGZRIDQX-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference R.H. Cox, L.A. Levy, Org. Magn. Resonance 21, 173 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3