SpectraBase Compound ID | KpfyUludPA3 |
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InChI | InChI=1S/C8H9FO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2H2,1H3 |
InChIKey | PURLWQWDGIIYBG-UHFFFAOYSA-N |
Mol Weight | 140.16 g/mol |
Molecular Formula | C8H9FO |
Exact Mass | 140.063743 g/mol |
SpectraBase Spectrum ID | sJEp9sMcAB |
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Name | p-Fluorophenetole |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 140.063743072 u |
Formula | C8H9FO |
InChI | InChI=1S/C8H9FO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2H2,1H3 |
InChIKey | PURLWQWDGIIYBG-UHFFFAOYSA-N |
Molecular Weight | 140.157 g/mol |
SMILES | C=1C(=CC=C(C1)F)OCC |
Spectrum/Structure Validation Score (Raman) | 0.960896 |