SpectraBase Compound ID | IirtBMEzpur |
---|---|
InChI | InChI=1S/C11H13FO2/c12-10-6-4-9(5-7-10)11(14)3-1-2-8-13/h4-7,13H,1-3,8H2 |
InChIKey | CSPIBDLLHQXFSZ-UHFFFAOYSA-N |
Mol Weight | 196.22 g/mol |
Molecular Formula | C11H13FO2 |
Exact Mass | 196.089958 g/mol |
SpectraBase Spectrum ID | 9ByIopFCnbU |
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Name | 4-Hydroxybut-1-yl-4-fluorobenzoate |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 196.089957820 u |
Formula | C11H13FO2 |
InChI | InChI=1S/C11H13FO2/c12-10-6-4-9(5-7-10)11(14)3-1-2-8-13/h4-7,13H,1-3,8H2 |
InChIKey | CSPIBDLLHQXFSZ-UHFFFAOYSA-N |
Molecular Weight | 196.221 g/mol |
SMILES | C1(F)=CC=C(C(=O)CCCCO)C=C1 |