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Phenylacetamide, 4-fluoro-N-butyl-

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Phenylacetamide, 4-fluoro-N-butyl-
SpectraBase Compound ID ABv2xulYi7n
InChI InChI=1S/C12H16FNO/c1-2-3-8-14-12(15)9-10-4-6-11(13)7-5-10/h4-7H,2-3,8-9H2,1H3,(H,14,15)
InChIKey WQJYAZPLSQHUSF-UHFFFAOYSA-N
Mol Weight 209.26 g/mol
Molecular Formula C12H16FNO
Exact Mass 209.121592 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3qrX7MiMkTX
Name Phenylacetamide, 4-fluoro-N-butyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 209.121592301 u
Formula C12H16FNO
InChI InChI=1S/C12H16FNO/c1-2-3-8-14-12(15)9-10-4-6-11(13)7-5-10/h4-7H,2-3,8-9H2,1H3,(H,14,15)
InChIKey WQJYAZPLSQHUSF-UHFFFAOYSA-N
Molecular Weight 209.264 g/mol
SMILES C(C(NCCCC)=O)C=1C=CC(=CC1)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.863387