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6-(2-Methylbutanamido)hexyl 2-methylbutanoate

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

6-(2-Methylbutanamido)hexyl 2-methylbutanoate
SpectraBase Compound ID 7GlTypeX3QS
InChI InChI=1S/C16H31NO3/c1-5-13(3)15(18)17-11-9-7-8-10-12-20-16(19)14(4)6-2/h13-14H,5-12H2,1-4H3,(H,17,18)
InChIKey IBYQENBCDPHNRG-UHFFFAOYSA-N
Mol Weight 285.43 g/mol
Molecular Formula C16H31NO3
Exact Mass 285.230394 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KPzHWuxyTuk
Name 6-(2-Methylbutanamido)hexyl 2-methylbutanoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 285.230393859 u
Formula C16H31NO3
InChI InChI=1S/C16H31NO3/c1-5-13(3)15(18)17-11-9-7-8-10-12-20-16(19)14(4)6-2/h13-14H,5-12H2,1-4H3,(H,17,18)
InChIKey IBYQENBCDPHNRG-UHFFFAOYSA-N
SMILES C(NC(=O)C(CC)C)CCCCCOC(C(CC)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.864694