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N-(2-oxo-1-Pentylazepan-3-yl)pivalamide

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N-(2-oxo-1-Pentylazepan-3-yl)pivalamide
SpectraBase Compound ID 3SmZ4GHAMpP
InChI InChI=1S/C16H30N2O2/c1-5-6-8-11-18-12-9-7-10-13(14(18)19)17-15(20)16(2,3)4/h13H,5-12H2,1-4H3,(H,17,20)
InChIKey GGLMZNKEPRGWKK-UHFFFAOYSA-N
Mol Weight 282.43 g/mol
Molecular Formula C16H30N2O2
Exact Mass 282.230728 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3QlrrB7ZWRZ
Name N-(2-oxo-1-Pentylazepan-3-yl)pivalamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.230728212 u
Formula C16H30N2O2
InChI InChI=1S/C16H30N2O2/c1-5-6-8-11-18-12-9-7-10-13(14(18)19)17-15(20)16(2,3)4/h13H,5-12H2,1-4H3,(H,17,20)
InChIKey GGLMZNKEPRGWKK-UHFFFAOYSA-N
SMILES C(C(C)(C)C)(=O)NC1C(N(CCCC1)CCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926739