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4,7,7-Trimethyl-3-exo-(1-naphthyl)-bicyclo(2.2.1)heptan-2-exo-yl 3-oxo-6-heptenoate

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4,7,7-Trimethyl-3-exo-(1-naphthyl)-bicyclo(2.2.1)heptan-2-exo-yl 3-oxo-6-heptenoate
SpectraBase Compound ID KLCrCrjyFrl
InChI InChI=1S/C27H32O3/c1-5-6-12-19(28)17-23(29)30-25-22-15-16-27(4,26(22,2)3)24(25)21-14-9-11-18-10-7-8-13-20(18)21/h5,7-11,13-14,22,24-25H,1,6,12,15-17H2,2-4H3/t22-,24?,25+,27+/m1/s1
InChIKey PCWRLLMMBRLKQM-IAEPFHKASA-N
Mol Weight 404.6 g/mol
Molecular Formula C27H32O3
Exact Mass 404.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PocT5DxpYI
Name 4,7,7-Trimethyl-3-exo-(1-naphthyl)-bicyclo(2.2.1)heptan-2-exo-yl 3-oxo-6-heptenoate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H32O3
InChI InChI=1S/C27H32O3/c1-5-6-12-19(28)17-23(29)30-25-22-15-16-27(4,26(22,2)3)24(25)21-14-9-11-18-10-7-8-13-20(18)21/h5,7-11,13-14,22,24-25H,1,6,12,15-17H2,2-4H3/t22-,24?,25+,27+/m1/s1
InChIKey PCWRLLMMBRLKQM-IAEPFHKASA-N
Instrument Name Bruker AC-250
Literature Reference D.F. Taber, P.B. Deker, M.D.Gaul, J. Am. Chem. Soc. 109, 7488 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3