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(-)-VALERONE

Compound with spectra: 1 NMR

(-)-VALERONE
SpectraBase Compound ID AyDBLKyRT4A
InChI InChI=1S/C15H26O/c1-11(2)12-7-9-14(3)8-5-6-13(16)15(14,4)10-12/h11-12H,5-10H2,1-4H3/t12?,14-,15-/m0/s1
InChIKey HDVXJTYHXDVWQO-ZRNAQANOSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol
Enantiomer InChIKey HDVXJTYHXDVWQO-JENMUQSASA-N

View Spectrum of (-)-VALERONE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
(4aS,7R,8aR)-4a,8a-dimethyl-7-propan-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one
1(2H)-Naphthalenone, octahydro-4a,8a-dimethyl-7-(1-methylethyl)-, [4aR-(4a.alpha.,7.beta.,8a.alpha.)]-
Valeranone
ISOFAURINONE
1(2H)-Naphthalenone, octahydro-6,8a-dihydroxy-4a-methyl-, (4a.alpha.,6.beta.,8a.alpha.)-(.+-.)-
trans, cis,cis-(10.4.4)Triannulene-16,18-dione
(1R*,6R*)-9-Methylene-6,7,7-trimethylbicyclo[4.2.0]nonan-2-one
Bicyclo[2.2.1]heptan-2-one, 7-(4-hydroxybutyl)-1,7-dimethyl-, (1R-syn)-
(5R*)-11,11-Dimethyldispiro[3.0.4.2]undecan-6-one
hexahydro-3a,7,7-trimethyl-7a-vinyl-1-indanone
Title Journal or Book Year
DFT and NMR parameterized conformation of valeranone Magnetic Resonance in Chemistry 2004

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