SpectraBase Compound ID | GFnQYF6534l |
---|---|
InChI | InChI=1S/C17H30O4/c1-5-12-20-15(18)10-11-16(19)21-14-8-6-13(7-9-14)17(2,3)4/h13-14H,5-12H2,1-4H3 |
InChIKey | IDMRWPLEEFUJFP-UHFFFAOYSA-N |
Mol Weight | 298.42 g/mol |
Molecular Formula | C17H30O4 |
Exact Mass | 298.214409 g/mol |
SpectraBase Spectrum ID | 44JsKUhExYk |
---|---|
Name | Succinic acid, propyl trans-4-tert-butylcyclohexyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 298.214409442 u |
Formula | C17H30O4 |
InChI | InChI=1S/C17H30O4/c1-5-12-20-15(18)10-11-16(19)21-14-8-6-13(7-9-14)17(2,3)4/h13-14H,5-12H2,1-4H3 |
InChIKey | IDMRWPLEEFUJFP-UHFFFAOYSA-N |
SMILES | C1C(CCC(C1)C(C)(C)C)OC(CCC(=O)OCCC)=O |