SpectraBase Spectrum ID |
5H8Sj7UDA1H |
Name |
Cyclobutanecarboxylic acid, 3-(5-ethoxy-3-methyl-5-oxo-1,3-pentadienyl)-2-[2-(4-methoxy-2,3,6-trimethylphenyl)ethenyl]-4-[6-(4-methoxy-2,3,6-trimethylphenyl)-4-methyl-1,3,5-hexatrienyl]-2,4-dimethyl-, ethyl ester, [1.alpha.,2.alpha.(E),3.beta.(1E,3E),4.beta.(1E,3E,5E)]-(.+-.)- |
CAS Registry Number |
113432-38-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C46H60O6 |
InChI |
InChI=1S/C46H60O6/c1-15-51-43(47)41-45(11,25-17-19-29(3)21-23-37-31(5)27-39(49-13)35(9)33(37)7)42(44(48)52-16-2)46(41,12)26-18-20-30(4)22-24-38-32(6)28-40(50-14)36(10)34(38)8/h17-28,41-42H,15-16H2,1-14H3/b23-21+,24-22+,25-17+,26-18+,29-19+,30-20+/t41-,42-,45-,46- |
InChIKey |
AODUCQMGJBVVHJ-BVGVMISVSA-N |
Molecular Weight |
708.980 g/mol |
SMILES |
[C@]1([C@@](C(=O)OCC)([C@@]([C@@]1(C(=O)OCC)[H])(\C=C\C=C\(\C=C\c1c(c(C)c(cc1C)OC)C)C)C)[H])(\C=C\C=C\(\C=C\c1c(c(C)c(cc1C)OC)C)C)C |
SPLASH |
splash10-0w29-0953000000-08108d0d663048e2f5d4 |
Source of Spectrum |
F-43-1332-2 |
Synonyms |
Diethyl 2,4-bis[(1E,3E,5E)-6-(4-methoxy-2,3,6-trimethylphenyl)-4-methyl-1,3,5-hexatrienyl]-2,4-dimethyl-1,3-cyclobutanedicarboxylate
Diethyl-2.beta.,4.alpha.-bis[(all-E)-6-(4-methoxy-2,3,6-trimethyl)-4-methyl-1,3,5-hexatrienyl]-2,4-dimethyl-1.alpha.,3.beta.-cyclobutane dicarboxylate
Ethyl 5-[3.alpha.-(ethoxycarbonyl)]-2.alpha.-[(E)-4-methoxy-1,2,6-trimethylstyryl]-4.beta.-[(all-E)-6-(4-methoxy-2,3,6-trimethylphenyl)-4-methyl-1,3,5-hexatrienyl]-2,4-dimethyl-1.beta.-cyclobutyl]-3-methyl-2,4-pentadienoate |
Wiley ID |
1415291 |