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1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohex-2-enyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene

Compound with spectra: 2 NMR

1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohex-2-enyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene
SpectraBase Compound ID 6oIH9Fentvv
InChI InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-28,37-38H,15-16,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+
InChIKey QABFXOMOOYWZLZ-JLTXGRSLSA-N
Mol Weight 536.9 g/mol
Molecular Formula C40H56
Exact Mass 536.438202 g/mol

View Spectrum of 1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohex-2-enyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene

13C NMR Spectrum
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Solvent CDCl3

View Spectrum of 1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohex-2-enyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • Iso.beta.-carotene
1,1-Dimethoxy-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
Silanol, [1,1-dimethyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)-2,4-pentadienyl]dimethyl-, (E,E)-
tert-Butyl (2Z,4E,8E)-3-Methyl-9-(2,6,6-trimethylcyclohexa-2-enyl)nona-2,4,8-trien-6-ynoate
(2Z,4E,8E)-3-Methyl-9-(2,6,6-trimethylcyclohexa-2-enyl)[2-2H]nona-2,4,8-trien-6-ynoic acid
TZQATZSBLLRCFA-AVYDKUFGSA-N
(2E)-1-Methyl-3-(2,6,6-trimethyl-2-cyclohexen-1-yl)-2-propenyl acetate
ALPHA-IONOL-SULFATE
(3E)-3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol
4-TRANS-METHYL-ALPHA-IONONE
4-[(1E)-1,3-Butadienyl]-3,5,5-trimethyl-2-cyclohexen-1-one
Title Journal or Book Year
A 13C‐NMR. Study of cis‐trans Isomeric Vitamins A, Carotenoids and Related Compounds Helvetica Chimica Acta 1975
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