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(2E,6E,10E)-(+)-4-BETA-HYDROXY-3-METHYL-5-BETA-(3,7,11,15-TETRAMETHYLHEXADECA-2,6,10,14-TETRAENYL)-CYCLOHEX-2-EN-1-ONE
SpectraBase Compound ID Le2Za8N6KXP
InChI InChI=1S/C27H42O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-23(5)16-17-25-19-26(28)18-24(6)27(25)29/h10,12,14,16,18,25,27,29H,7-9,11,13,15,17,19H2,1-6H3/b21-12+,22-14+,23-16+/t25-,27+/m0/s1
InChIKey HOMSLHHQMMWTPW-TWXQUNJUSA-N
Mol Weight 398.6 g/mol
Molecular Formula C27H42O2
Exact Mass 398.318481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1UgIVBI0JeT
Name (2E,6E,10E)-(+)-4-BETA-HYDROXY-3-METHYL-5-BETA-(3,7,11,15-TETRAMETHYLHEXADECA-2,6,10,14-TETRAENYL)-CYCLOHEX-2-EN-1-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O2
InChI InChI=1S/C27H42O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-23(5)16-17-25-19-26(28)18-24(6)27(25)29/h10,12,14,16,18,25,27,29H,7-9,11,13,15,17,19H2,1-6H3/b21-12+,22-14+,23-16+/t25-,27+/m0/s1
InChIKey HOMSLHHQMMWTPW-TWXQUNJUSA-N
Literature Reference Author F.S.WAHYUNI,L.T.BYRNE,X.DACHRIYANUS,R.DIANITA,J.JUBAHAR,N.H. LAJIS,M.V.SARGENT
Literature Reference Citation AUSTR.J.CHEM.,57,223(2004)
Literature Reference DOI 10.1071/CH03175
Molecular Weight 398.629 g/mol
Solvent CDCl3
Source File Reference UWVN7482