SpectraBase Compound ID | DwpAp4jhPp2 |
---|---|
InChI | InChI=1S/C16H15FO2/c17-15-11-5-4-10-14(15)16(18)19-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11H,6,9,12H2 |
InChIKey | RLWULCLRUZMATG-UHFFFAOYSA-N |
Mol Weight | 258.29 g/mol |
Molecular Formula | C16H15FO2 |
Exact Mass | 258.105608 g/mol |
SpectraBase Spectrum ID | 3TU4dEx9rBA |
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Name | 2-Fluorobenzoic acid, 3-phenylpropyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 258.105607884 u |
Formula | C16H15FO2 |
InChI | InChI=1S/C16H15FO2/c17-15-11-5-4-10-14(15)16(18)19-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11H,6,9,12H2 |
InChIKey | RLWULCLRUZMATG-UHFFFAOYSA-N |
Molecular Weight | 258.292 g/mol |
SMILES | C1=CC=CC=C1CCCOC(=O)C1=CC=CC=C1F |