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(E)-6-[(AS)-4-METHYL-CYClOHEXYLIDENE]-2,2-DIMETHYL-4-HEXEN-3-ONE;VITAMIN-D-DERIVATIVE
SpectraBase Compound ID 428JOhcxZAW
InChI InChI=1S/C15H24O/c1-12-8-10-13(11-9-12)6-5-7-14(16)15(2,3)4/h5-7,12H,8-11H2,1-4H3/b7-5+,13-6-/t12-/m0/s1
InChIKey CBLNRPDLVLKVIG-YGBSXNOVSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Xoqqeq0U6n
Name (E)-6-[(AS)-4-METHYL-CYClOHEXYLIDENE]-2,2-DIMETHYL-4-HEXEN-3-ONE;VITAMIN-D-DERIVATIVE
CAS Registry Number 102633-34-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-12-8-10-13(11-9-12)6-5-7-14(16)15(2,3)4/h5-7,12H,8-11H2,1-4H3/b7-5+,13-6-/t12-/m0/s1
InChIKey CBLNRPDLVLKVIG-YGBSXNOVSA-N
Literature Reference Author J.K.GAWRONSKI,H.M.WALBORSKY
Literature Reference Citation J.ORG.CHEM.,51,2863(1986)
Literature Reference DOI 10.1021/jo00365a002
Molecular Weight 220.355 g/mol
Solvent CDCl3
Source File Reference UWWR5129