SpectraBase Compound ID | LXyQuflYNyz |
---|---|
InChI | InChI=1S/C14H22O5/c1-2-19-13(17)9-7-11-5-3-4-10(14(11)18)6-8-12(15)16/h10-11H,2-9H2,1H3,(H,15,16) |
InChIKey | QKCFWEHBDFQBKF-UHFFFAOYSA-N |
Mol Weight | 270.32 g/mol |
Molecular Formula | C14H22O5 |
Exact Mass | 270.146724 g/mol |
SpectraBase Spectrum ID | 2LlJEB1a7yC |
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Name | 1,3-Cyclohexanedipropanoic acid, 2-oxo-, ethyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 270.146723803 u |
Formula | C14H22O5 |
InChI | InChI=1S/C14H22O5/c1-2-19-13(17)9-7-11-5-3-4-10(14(11)18)6-8-12(15)16/h10-11H,2-9H2,1H3,(H,15,16) |
InChIKey | QKCFWEHBDFQBKF-UHFFFAOYSA-N |
SMILES | C1(=O)C(CCC(=O)O)CCCC1CCC(=O)OCC |