| SpectraBase Spectrum ID |
DrxV5mN9ory |
| Name |
2,4-Pentadienoic acid, 5-[4-(acetyloxy)-1,2-dihydroxy-2,6,6-trimethylcyclohexyl]-3-methyl-, ethyl ester, [1S-[1.alpha.,1(2E,4E),2.beta.,4.beta.]]- |
| Alternate Name(s) |
Ethyl (2E,4E)-5-[(1S,2R,4R)-4-(acetyloxy)-1,2-dihydroxy-2,6,6-trimethylcyclohexyl]-3-methyl-2,4-pentadienoate
Ethyl ester of[(3S,5S,6S)-3-acetoxy-5,6-dihydroxy-5,6-dihydro-.beta.-ionylidene]acetic acid |
| CAS Registry Number |
96193-05-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H30O6 |
| InChI |
InChI=1S/C19H30O6/c1-7-24-16(21)10-13(2)8-9-19(23)17(4,5)11-15(25-14(3)20)12-18(19,6)22/h8-10,15,22-23H,7,11-12H2,1-6H3/b9-8+,13-10+/t15-,18-,19+/m1/s1 |
| InChIKey |
GUYNVLRHQNRDJA-BSYGLDMSSA-N |
| Molecular Weight |
354.443 g/mol |
| SMILES |
O[C@]1([C@@](C(C[C@](C1)(OC(=O)C)[H])(C)C)(\C=C\C(=C\C(=O)OCC)C)O)C |
| SPLASH |
splash10-0006-9020000000-190042756a67659b566f |
| Source of Spectrum |
H-67-2053-0 |
| Wiley ID |
1344513 |
![2,4-Pentadienoic acid, 5-[4-(acetyloxy)-1,2-dihydroxy-2,6,6-trimethylcyclohexyl]-3-methyl-, ethyl ester, [1S-[1.alpha.,1(2E,4E),2.beta.,4.beta.]]-](/api/spectrum/DrxV5mN9ory/structure.png?h=300&w=458 "2,4-Pentadienoic acid, 5-[4-(acetyloxy)-1,2-dihydroxy-2,6,6-trimethylcyclohexyl]-3-methyl-, ethyl ester, [1S-[1.alpha.,1(2E,4E),2.beta.,4.beta.]]-")
