| SpectraBase Spectrum ID |
8exTmaHF9Ur |
| Name |
Methyl ester of [1.alpha.,3a.beta.,4.beta.(E),7a.alpha.]-3-(octahydro-1-hydroxy-7a-methyl-6-oxo-1H-inden-4-yl)-2-propenoic acid |
| Alternate Name(s) |
Methyl (2E)-3-[(1R,3aR,4R,7aR)-1-hydroxy-7a-methyl-6-oxooctahydro-1H-inden-4-yl]-2-propenoate |
| CAS Registry Number |
91202-66-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O4 |
| InChI |
InChI=1S/C14H20O4/c1-14-8-10(15)7-9(3-6-13(17)18-2)11(14)4-5-12(14)16/h3,6,9,11-12,16H,4-5,7-8H2,1-2H3/b6-3+/t9-,11+,12+,14+/m0/s1 |
| InChIKey |
CTBLXWBNEPUGEY-GMMUPYNCSA-N |
| Molecular Weight |
252.310 g/mol |
| SMILES |
O[C@]1([C@]2([C@@]([C@@](\C=C\C(=O)OC)(CC(C2)=O)[H])(CC1)[H])C)[H] |
| SPLASH |
splash10-01q9-4910000000-4216bab8afa9d795f5eb |
| Source of Spectrum |
J-49-3281-0 |
| Wiley ID |
1255557 |
![Methyl ester of [1.alpha.,3a.beta.,4.beta.(E),7a.alpha.]-3-(octahydro-1-hydroxy-7a-methyl-6-oxo-1H-inden-4-yl)-2-propenoic acid](/api/spectrum/8exTmaHF9Ur/structure.png?h=300&w=458 "Methyl ester of [1.alpha.,3a.beta.,4.beta.(E),7a.alpha.]-3-(octahydro-1-hydroxy-7a-methyl-6-oxo-1H-inden-4-yl)-2-propenoic acid")
