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(2S,3R,3aS,4R,6S,6aS)-2-butyl-3-methyl-4,6-dimethylol-3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-one
SpectraBase Compound ID ZPnm1Iz4b0
InChI InChI=1S/C15H26O3/c1-3-4-5-12-9(2)13-10(7-16)6-11(8-17)14(13)15(12)18/h9-14,16-17H,3-8H2,1-2H3/t9-,10-,11+,12-,13-,14+/m0/s1
InChIKey OATQKUGWGMOEIW-KYTCRMMBSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hmru2EZB9Tb
Name (2S,3R,3aS,4R,6S,6aS)-2-butyl-3-methyl-4,6-dimethylol-3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-one
Compound Number 10D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-3-4-5-12-9(2)13-10(7-16)6-11(8-17)14(13)15(12)18/h9-14,16-17H,3-8H2,1-2H3/t9-,10-,11+,12-,13-,14+/m0/s1
InChIKey OATQKUGWGMOEIW-KYTCRMMBSA-N
Literature Reference Author A.BECHEANU,A.BARO,S.LASCHAT,W.FREY
Literature Reference Citation EUR.J.ORG.CHEM.,2215(2006)
Literature Reference DOI 10.1002/ejoc.200500966
Molecular Weight 254.370 g/mol
Sample ID 46511
Solvent ACETONE-D6