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(3-(Acetamidomethyl)-5-methylcyclohexyl)methyl acetate

View entire compound with spectra: 1 FTIR

(3-(Acetamidomethyl)-5-methylcyclohexyl)methyl acetate
SpectraBase Compound ID 8gBJMJIs67c
InChI InChI=1S/C13H23NO3/c1-9-4-12(7-14-10(2)15)6-13(5-9)8-17-11(3)16/h9,12-13H,4-8H2,1-3H3,(H,14,15)
InChIKey HLRLALDUIJVCPV-UHFFFAOYSA-N
Mol Weight 241.33 g/mol
Molecular Formula C13H23NO3
Exact Mass 241.167794 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7KVGG6mINjR
Name (3-(Acetamidomethyl)-5-methylcyclohexyl)methyl acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 241.167793602 u
Formula C13H23NO3
InChI InChI=1S/C13H23NO3/c1-9-4-12(7-14-10(2)15)6-13(5-9)8-17-11(3)16/h9,12-13H,4-8H2,1-3H3,(H,14,15)
InChIKey HLRLALDUIJVCPV-UHFFFAOYSA-N
Molecular Weight 241.331 g/mol
SMILES C(NC(C)=O)C1CC(CC(C1)C)COC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.977913