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Isovaleramide, N-(2-butyl)-N-heptyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Isovaleramide, N-(2-butyl)-N-heptyl-
SpectraBase Compound ID 7JBZoLOm4J0
InChI InChI=1S/C16H33NO/c1-6-8-9-10-11-12-17(15(5)7-2)16(18)13-14(3)4/h14-15H,6-13H2,1-5H3
InChIKey IKKPVIHEOWCCHO-UHFFFAOYSA-N
Mol Weight 255.4 g/mol
Molecular Formula C16H33NO
Exact Mass 255.256215 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5KHkTEAp6zO
Name Isovaleramide, N-(2-butyl)-N-heptyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.256214686 u
Formula C16H33NO
InChI InChI=1S/C16H33NO/c1-6-8-9-10-11-12-17(15(5)7-2)16(18)13-14(3)4/h14-15H,6-13H2,1-5H3
InChIKey IKKPVIHEOWCCHO-UHFFFAOYSA-N
Molecular Weight 255.446 g/mol
SMILES C(N(CCCCCCC)C(CC)C)(=O)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.850833