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Hexanamide, 3,5,5-trimethyl-N-heptyl-
SpectraBase Compound ID 7obZI0klKoM
InChI InChI=1S/C16H33NO/c1-6-7-8-9-10-11-17-15(18)12-14(2)13-16(3,4)5/h14H,6-13H2,1-5H3,(H,17,18)
InChIKey KXWQLYPAOLCPMU-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 JyYHZeZrtYE
Name Hexanamide, 3,5,5-trimethyl-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/c1-6-7-8-9-10-11-17-15(18)12-14(2)13-16(3,4)5/h14H,6-13H2,1-5H3,(H,17,18)
InChIKey KXWQLYPAOLCPMU-UHFFFAOYSA-N
Molecular Weight 255.446 g/mol
SMILES C(=O)(NCCCCCCC)CC(CC(C)(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.9666