SpectraBase Compound ID | 6c4RukZ1XFY |
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InChI | InChI=1S/C10H12ClFO/c1-7(2)6-13-10-8(11)4-3-5-9(10)12/h3-5,7H,6H2,1-2H3 |
InChIKey | IVBVZOFHNSAYJT-UHFFFAOYSA-N |
Mol Weight | 202.66 g/mol |
Molecular Formula | C10H12ClFO |
Exact Mass | 202.056071 g/mol |
SpectraBase Spectrum ID | 7IvsgE8Ba9s |
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Name | 2-Chloro-6-fluorophenol, 2-methylpropyl ether |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 202.056070868 u |
Formula | C10H12ClFO |
InChI | InChI=1S/C10H12ClFO/c1-7(2)6-13-10-8(11)4-3-5-9(10)12/h3-5,7H,6H2,1-2H3 |
InChIKey | IVBVZOFHNSAYJT-UHFFFAOYSA-N |
Molecular Weight | 202.656 g/mol |
SMILES | C1(=CC=CC(=C1OCC(C)C)Cl)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.870236 |