SpectraBase Compound ID | 5LM6UbgXlg8 |
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InChI | InChI=1S/C14H15F3O4/c1-2-20-12(18)7-8-13(19)21-9-10-3-5-11(6-4-10)14(15,16)17/h3-6H,2,7-9H2,1H3 |
InChIKey | IDZKKIQDQGNMFE-UHFFFAOYSA-N |
Mol Weight | 304.27 g/mol |
Molecular Formula | C14H15F3O4 |
Exact Mass | 304.092243 g/mol |
SpectraBase Spectrum ID | 1aW7nSHxt6F |
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Name | Succinic acid, ethyl 4-trifluoromethylbenzyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 304.092243448 u |
Formula | C14H15F3O4 |
InChI | InChI=1S/C14H15F3O4/c1-2-20-12(18)7-8-13(19)21-9-10-3-5-11(6-4-10)14(15,16)17/h3-6H,2,7-9H2,1H3 |
InChIKey | IDZKKIQDQGNMFE-UHFFFAOYSA-N |
Molecular Weight | 304.265 g/mol |
SMILES | C(C1=CC=C(COC(=O)CCC(OCC)=O)C=C1)(F)(F)F |