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3-Aminopyridine, N-heptafluorobutyryl-

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3-Aminopyridine, N-heptafluorobutyryl-
SpectraBase Compound ID E4qxii1YJCu
InChI InChI=1S/C9H5F7N2O/c10-7(11,8(12,13)9(14,15)16)6(19)18-5-2-1-3-17-4-5/h1-4H,(H,18,19)
InChIKey XHEPDLWUNJJNFP-UHFFFAOYSA-N
Mol Weight 290.14 g/mol
Molecular Formula C9H5F7N2O
Exact Mass 290.02901 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B44kkKAinQ
Name 3-Aminopyridine, N-heptafluorobutyryl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.029009929 u
Formula C9H5F7N2O
InChI InChI=1S/C9H5F7N2O/c10-7(11,8(12,13)9(14,15)16)6(19)18-5-2-1-3-17-4-5/h1-4H,(H,18,19)
InChIKey XHEPDLWUNJJNFP-UHFFFAOYSA-N
Molecular Weight 290.141 g/mol
SMILES C1(=CN=CC=C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822916