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Acetamide, N-methyl-N-[4-[4-fluoro-1-hexahydropyridyl]-2-butynyl]-
SpectraBase Compound ID 6rVJ53zpVB4
InChI InChI=1S/C12H19FN2O/c1-11(16)14(2)7-3-4-8-15-9-5-12(13)6-10-15/h12H,5-10H2,1-2H3
InChIKey AREUHIWMSXFILA-UHFFFAOYSA-N
Mol Weight 226.3 g/mol
Molecular Formula C12H19FN2O
Exact Mass 226.148141 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9m53RQEJpxY
Name Acetamide, N-methyl-N-[4-[4-fluoro-1-hexahydropyridyl]-2-butynyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.148141402 u
Formula C12H19FN2O
InChI InChI=1S/C12H19FN2O/c1-11(16)14(2)7-3-4-8-15-9-5-12(13)6-10-15/h12H,5-10H2,1-2H3
InChIKey AREUHIWMSXFILA-UHFFFAOYSA-N
Molecular Weight 226.295 g/mol
SMILES C1N(CCC(C1)F)CC#CCN(C(C)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.98083