SpectraBase Spectrum ID |
JA5zIl4mhtA |
Name |
Methyl (trans)-4-(2'-oxo-3'-methylcyclopentyl)-4-methylvalerate |
Alternate Name(s) |
Methyl 4-methyl-4-[(1S,3R)-3-methyl-2-oxocyclopentyl]pentanoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H22O3 |
InChI |
InChI=1S/C13H22O3/c1-9-5-6-10(12(9)15)13(2,3)8-7-11(14)16-4/h9-10H,5-8H2,1-4H3/t9-,10-/m1/s1 |
InChIKey |
XGIHUGKMRZMTTB-NXEZZACHSA-N |
Molecular Weight |
226.316 g/mol |
SMILES |
C1([C@](C(CCC(=O)OC)(C)C)(CC[C@]1(C)[H])[H])=O |
SPLASH |
splash10-00mt-9810000000-2ca6e7c140749d43fda4 |
Source of Spectrum |
D1-1995-1251-3 |
Wiley ID |
834605 |