| SpectraBase Spectrum ID |
DK3Ou63XMWL |
| Name |
2-Butenoic acid, 2-methyl-4-[4,6,6-trimethyl-5-(3-oxo-1-butenyl)-3-cyclohexen-1-yl]-, ethyl ester, [1R-[1.alpha.(E),5.alpha.(E)]]- |
| Alternate Name(s) |
Ethyl (1'R,5'R)-2-methyl-4-[4',6',6'-trimethyl-5'-(3''-oxobut-1''-enyl)cyclohex-3'-enyl]but-2-enoate
Ethyl (2E)-2-methyl-4-{(1R,5S)-4,6,6-trimethyl-5-[(1E)-3-oxo-1-butenyl]-3-cyclohexen-1-yl}-2-butenoate |
| CAS Registry Number |
123393-07-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O3 |
| InChI |
InChI=1S/C20H30O3/c1-7-23-19(22)15(3)9-12-17-11-8-14(2)18(20(17,5)6)13-10-16(4)21/h8-10,13,17-18H,7,11-12H2,1-6H3/b13-10+,15-9+/t17-,18+/m1/s1 |
| InChIKey |
HNKNUMAZLCTZQX-YPUWEYLCSA-N |
| Molecular Weight |
318.457 g/mol |
| SMILES |
[C@@]1(C([C@@](C\C=C\(C(=O)OCC)C)(CC=C1C)[H])(C)C)(\C=C\C(=O)C)[H] |
| SPLASH |
splash10-05fr-2900000000-40336f5d094083725d49 |
| Source of Spectrum |
H-72-156-14 |
| Wiley ID |
1318806 |
![2-Butenoic acid, 2-methyl-4-[4,6,6-trimethyl-5-(3-oxo-1-butenyl)-3-cyclohexen-1-yl]-, ethyl ester, [1R-[1.alpha.(E),5.alpha.(E)]]-](/api/spectrum/DK3Ou63XMWL/structure.png?h=300&w=458 "2-Butenoic acid, 2-methyl-4-[4,6,6-trimethyl-5-(3-oxo-1-butenyl)-3-cyclohexen-1-yl]-, ethyl ester, [1R-[1.alpha.(E),5.alpha.(E)]]-")
