| SpectraBase Spectrum ID |
4Aud7yfAyFp |
| Name |
3-Cyclopentene-1-octanoic acid, 2-hydroxy-3,4-dimethyl-5-oxo-2-pentyl-, methyl ester, trans- |
| CAS Registry Number |
99290-32-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H36O4 |
| InChI |
InChI=1S/C21H36O4/c1-5-6-12-15-21(24)17(3)16(2)20(23)18(21)13-10-8-7-9-11-14-19(22)25-4/h18,24H,5-15H2,1-4H3/t18-,21+/m1/s1 |
| InChIKey |
YSSFOFOZEJHHKQ-NQIIRXRSSA-N |
| Molecular Weight |
352.515 g/mol |
| SMILES |
O[C@]1(C(=C(C(=O)[C@]1(CCCCCCCC(=O)OC)[H])C)C)CCCCC |
| SPLASH |
splash10-000b-0961000000-6abedc3c50ed19ea533f |
| Source of Spectrum |
H-68-1633-4 |
| Synonyms |
8-(5-Hydroxy-3,4-dimethyl-2-oxo-5-pentyl-3-cyclopentenyl)octansaure-methylester
Methyl 8-[(1S,2R)-2-hydroxy-3,4-dimethyl-5-oxo-2-pentyl-3-cyclopenten-1-yl]octanoate |
| Wiley ID |
1343515 |
