SpectraBase Compound ID | 50yGLI46YZN |
---|---|
InChI | InChI=1S/C7H6FIO/c1-10-7-5(8)3-2-4-6(7)9/h2-4H,1H3 |
InChIKey | RYQJQWYSGFSMFV-UHFFFAOYSA-N |
Mol Weight | 252.03 g/mol |
Molecular Formula | C7H6FIO |
Exact Mass | 251.944738 g/mol |
SpectraBase Spectrum ID | ChKN9hBiLh3 |
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Name | 2-Fluoro-6-iodoanisole |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 251.944737975 u |
Formula | C7H6FIO |
InChI | InChI=1S/C7H6FIO/c1-10-7-5(8)3-2-4-6(7)9/h2-4H,1H3 |
InChIKey | RYQJQWYSGFSMFV-UHFFFAOYSA-N |
Molecular Weight | 252.027 g/mol |
SMILES | C1(I)=C(C(=CC=C1)F)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.845405 |