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Hexanamide, 3,5,5-trimethyl-N-3-methylbutyl-

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Hexanamide, 3,5,5-trimethyl-N-3-methylbutyl-
SpectraBase Compound ID V6djyCzVwY
InChI InChI=1S/C14H29NO/c1-11(2)7-8-15-13(16)9-12(3)10-14(4,5)6/h11-12H,7-10H2,1-6H3,(H,15,16)
InChIKey CTEGMJKULJXFQQ-UHFFFAOYSA-N
Mol Weight 227.39 g/mol
Molecular Formula C14H29NO
Exact Mass 227.224915 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GYMlAML06fT
Name Hexanamide, 3,5,5-trimethyl-N-3-methylbutyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 227.224914557 u
Formula C14H29NO
InChI InChI=1S/C14H29NO/c1-11(2)7-8-15-13(16)9-12(3)10-14(4,5)6/h11-12H,7-10H2,1-6H3,(H,15,16)
InChIKey CTEGMJKULJXFQQ-UHFFFAOYSA-N
Molecular Weight 227.392 g/mol
SMILES C(=O)(NCCC(C)C)CC(CC(C)(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902566