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Hexanamide, 3,5,5-trimethyl-N-dodecyl-

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Hexanamide, 3,5,5-trimethyl-N-dodecyl-
SpectraBase Compound ID 1MkxPl5X9Jt
InChI InChI=1S/C21H43NO/c1-6-7-8-9-10-11-12-13-14-15-16-22-20(23)17-19(2)18-21(3,4)5/h19H,6-18H2,1-5H3,(H,22,23)
InChIKey AQVUOSRABYPVLU-UHFFFAOYSA-N
Mol Weight 325.6 g/mol
Molecular Formula C21H43NO
Exact Mass 325.334465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Fhcq3DE1y5X
Name Hexanamide, 3,5,5-trimethyl-N-dodecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.334465008 u
Formula C21H43NO
InChI InChI=1S/C21H43NO/c1-6-7-8-9-10-11-12-13-14-15-16-22-20(23)17-19(2)18-21(3,4)5/h19H,6-18H2,1-5H3,(H,22,23)
InChIKey AQVUOSRABYPVLU-UHFFFAOYSA-N
Molecular Weight 325.581 g/mol
SMILES C(=O)(NCCCCCCCCCCCC)CC(CC(C)(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.936016