SpectraBase Compound ID | 4VnYdcTYSp4 |
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InChI | InChI=1S/C11H14FNO/c1-3-13-8(2)11(14)9-4-6-10(12)7-5-9/h4-8,13H,3H2,1-2H3 |
InChIKey | KBNVGQPMFGSPPT-UHFFFAOYSA-N |
Mol Weight | 195.24 g/mol |
Molecular Formula | C11H14FNO |
Exact Mass | 195.105942 g/mol |
SpectraBase Spectrum ID | 1RTky4eYZMy |
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Name | 4-Fluoroethcathinone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 195.105942237 u |
Formula | C11H14FNO |
InChI | InChI=1S/C11H14FNO/c1-3-13-8(2)11(14)9-4-6-10(12)7-5-9/h4-8,13H,3H2,1-2H3 |
InChIKey | KBNVGQPMFGSPPT-UHFFFAOYSA-N |
Molecular Weight | 195.237 g/mol |
SMILES | C1=C(C=CC(=C1)C(C(NCC)C)=O)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937177 |