SpectraBase Compound ID | 5qmlK053Kbi |
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InChI | InChI=1S/C10H11FN2O/c1-6-9(14-10(12)13-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H2,12,13) |
InChIKey | UYKYWISHPDEDRQ-UHFFFAOYSA-N |
Mol Weight | 194.21 g/mol |
Molecular Formula | C10H11FN2O |
Exact Mass | 194.085541 g/mol |
SpectraBase Spectrum ID | BtDxltXjZ6k |
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Name | p-Fluoro-4-methylaminorex |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 194.085541144 u |
Formula | C10H11FN2O |
InChI | InChI=1S/C10H11FN2O/c1-6-9(14-10(12)13-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H2,12,13) |
InChIKey | UYKYWISHPDEDRQ-UHFFFAOYSA-N |
Molecular Weight | 194.209 g/mol |
SMILES | C1(C2=CC=C(C=C2)F)C(N=C(O1)N)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841774 |