SpectraBase Spectrum ID |
KtUr82GwoeT |
Name |
isopropyl 2-(1,2,2-trimethylcyclopentyl)propanoate |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H26O2 |
InChI |
InChI=1S/C14H26O2/c1-10(2)16-12(15)11(3)14(6)9-7-8-13(14,4)5/h10-11H,7-9H2,1-6H3 |
InChIKey |
BSSMYWZXZWMWPM-UHFFFAOYSA-N |
Instrument Name |
MSD5975C |
Ionization Type |
EI |
Molecular Weight |
226.360 g/mol |
SMILES |
C(OC(=O)C(C1(C)CCCC1(C)C)C)(C)C |
SPLASH |
splash10-0aou-9300000000-685b0fb8f784073d6b87 |
Sample Comments |
Major isomer, dr = 6:1 |
Source of Spectrum |
WO2017097884A1 |
Wiley ID |
1855421 |