SpectraBase Compound ID | 7Xb5B4uspdB |
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InChI | InChI=1S/C20H37F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(24)25-18-20(21,22)23/h2-18H2,1H3 |
InChIKey | LUCFOTSFIDOKNU-UHFFFAOYSA-N |
Mol Weight | 366.5 g/mol |
Molecular Formula | C20H37F3O2 |
Exact Mass | 366.274565 g/mol |
SpectraBase Spectrum ID | 8IgEG0e0ODh |
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Name | Octadecanoic acid, 2,2,2- trifluoroethyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 366.274564918 u |
Formula | C20H37F3O2 |
InChI | InChI=1S/C20H37F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(24)25-18-20(21,22)23/h2-18H2,1H3 |
InChIKey | LUCFOTSFIDOKNU-UHFFFAOYSA-N |
Molecular Weight | 366.509 g/mol |
SMILES | C(CCCCCCCCCCCCC(OCC(F)(F)F)=O)CCCC |