| SpectraBase Spectrum ID |
E0mzk6YPb9z |
| Name |
methyl 2-(1,2,2-trimethylcyclopentyl)propanoate |
| Appearance |
Light yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22O2 |
| InChI |
InChI=1S/C12H22O2/c1-9(10(13)14-5)12(4)8-6-7-11(12,2)3/h9H,6-8H2,1-5H3 |
| InChIKey |
PQZOPOYPNQOKCG-UHFFFAOYSA-N |
| Instrument Name |
MSD5975C |
| Ionization Type |
EI |
| Molecular Weight |
198.306 g/mol |
| SMILES |
COC(=O)C(C1(C)CCCC1(C)C)C |
| SPLASH |
splash10-0ap3-9200000000-4dc209d82bd127b8cbc4 |
| Sample Comments |
Minor isomer, dr = 2.5:1 |
| Source of Spectrum |
WO2017097884A1 |
| Wiley ID |
1855419 |
