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(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trienyl]cyclopropane-1-carboxylic acid methyl ester

View entire compound with spectra: 1 NMR

(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trienyl]cyclopropane-1-carboxylic acid methyl ester
SpectraBase Compound ID 6VEagFHlpJN
InChI InChI=1S/C31H50O2/c1-23(2)14-10-16-25(5)18-12-19-27(7)22-28-29(30(32)33-9)31(28,8)21-13-20-26(6)17-11-15-24(3)4/h14-15,18,20,22,28-29H,10-13,16-17,19,21H2,1-9H3/b25-18+,26-20+,27-22+/t28-,29+,31-/m0/s1
InChIKey WBFDKPBJANOVNP-CFHIWUMYSA-N
Mol Weight 454.7 g/mol
Molecular Formula C31H50O2
Exact Mass 454.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EawSYUUKHVX
Name (1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trienyl]cyclopropane-1-carboxylic acid methyl ester
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O2
InChI InChI=1S/C31H50O2/c1-23(2)14-10-16-25(5)18-12-19-27(7)22-28-29(30(32)33-9)31(28,8)21-13-20-26(6)17-11-15-24(3)4/h14-15,18,20,22,28-29H,10-13,16-17,19,21H2,1-9H3/b25-18+,26-20+,27-22+/t28-,29+,31-/m0/s1
InChIKey WBFDKPBJANOVNP-CFHIWUMYSA-N
Literature Reference Author L.CROMBIE,R.W.KING,D.A.WHITING
Literature Reference Citation J.CHEM.SOC.PERKIN-1,913(1975)
Molecular Weight 454.737 g/mol
Solvent CDCl3
Source File Reference UWCS8921