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(+)-1-(Z)-(1R,4R,6S)-1-(5-ACETOXY-3-METHYLPENT-3-EN-1-YNYL)-2,2,6-TRIMETHYLCYCLOHEXAN-1,4-DIOL
SpectraBase Compound ID 1n9cszdK449
InChI InChI=1S/C17H26O4/c1-12(7-9-21-14(3)18)6-8-17(20)13(2)10-15(19)11-16(17,4)5/h7,13,15,19-20H,9-11H2,1-5H3/b12-7+/t13-,15-,17-/m1/s1
InChIKey KVGOKFPNLVGFBP-BLQLXGBPSA-N
Mol Weight 294.39 g/mol
Molecular Formula C17H26O4
Exact Mass 294.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DkvJ5BIm3oo
Name (+)-1-(Z)-(1R,4R,6S)-1-(5-ACETOXY-3-METHYLPENT-3-EN-1-YNYL)-2,2,6-TRIMETHYLCYCLOHEXAN-1,4-DIOL
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Formula C17H26O4
InChI InChI=1S/C17H26O4/c1-12(7-9-21-14(3)18)6-8-17(20)13(2)10-15(19)11-16(17,4)5/h7,13,15,19-20H,9-11H2,1-5H3/b12-7+/t13-,15-,17-/m1/s1
InChIKey KVGOKFPNLVGFBP-BLQLXGBPSA-N
Literature Reference Author N.LAMB,S.R.ABRAMS
Literature Reference Citation CAN.J.CHEM.,68,1151(1990)
Literature Reference DOI 10.1139/v90-178
Molecular Weight 294.391 g/mol
Solvent CDCl3
Source File Reference UWED11209