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Heptanamide, N-(1-cyclohexylethyl)-2-methyl-

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

Heptanamide, N-(1-cyclohexylethyl)-2-methyl-
SpectraBase Compound ID C9Z9CcUZD9o
InChI InChI=1S/C16H31NO/c1-4-5-7-10-13(2)16(18)17-14(3)15-11-8-6-9-12-15/h13-15H,4-12H2,1-3H3,(H,17,18)
InChIKey XJWYRIIVOOKLIP-UHFFFAOYSA-N
Mol Weight 253.43 g/mol
Molecular Formula C16H31NO
Exact Mass 253.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CLO5f8GCPmS
Name Heptanamide, N-(1-cyclohexylethyl)-2-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.240564621 u
Formula C16H31NO
InChI InChI=1S/C16H31NO/c1-4-5-7-10-13(2)16(18)17-14(3)15-11-8-6-9-12-15/h13-15H,4-12H2,1-3H3,(H,17,18)
InChIKey XJWYRIIVOOKLIP-UHFFFAOYSA-N
Molecular Weight 253.430 g/mol
SMILES C1(CCCCC1)C(NC(C(CCCCC)C)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954044