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Hexanamide, 3,5,5-trimethyl-N-isobutyl-

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Hexanamide, 3,5,5-trimethyl-N-isobutyl-
SpectraBase Compound ID AUPkfYqV4jR
InChI InChI=1S/C13H27NO/c1-10(2)9-14-12(15)7-11(3)8-13(4,5)6/h10-11H,7-9H2,1-6H3,(H,14,15)
InChIKey JLWKHTOFBKLAMB-UHFFFAOYSA-N
Mol Weight 213.36 g/mol
Molecular Formula C13H27NO
Exact Mass 213.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JoftU1I4HTg
Name Hexanamide, 3,5,5-trimethyl-N-isobutyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.209264492 u
Formula C13H27NO
InChI InChI=1S/C13H27NO/c1-10(2)9-14-12(15)7-11(3)8-13(4,5)6/h10-11H,7-9H2,1-6H3,(H,14,15)
InChIKey JLWKHTOFBKLAMB-UHFFFAOYSA-N
Molecular Weight 213.365 g/mol
SMILES C(=O)(NCC(C)C)CC(CC(C)(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.897971