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1-Propanone, 1-(2,6-dimethylphenyl)-2-methyl-3-(1-piperidyl)-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1-Propanone, 1-(2,6-dimethylphenyl)-2-methyl-3-(1-piperidyl)-
SpectraBase Compound ID Gb2AajU1bHT
InChI InChI=1S/C17H25NO/c1-13-8-7-9-14(2)16(13)17(19)15(3)12-18-10-5-4-6-11-18/h7-9,15H,4-6,10-12H2,1-3H3
InChIKey UKJUFRCYOPICDD-UHFFFAOYSA-N
Mol Weight 259.39 g/mol
Molecular Formula C17H25NO
Exact Mass 259.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Fb9yY0RP4US
Name 1-Propanone, 1-(2,6-dimethylphenyl)-2-methyl-3-(1-piperidyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.193614428 u
Formula C17H25NO
InChI InChI=1S/C17H25NO/c1-13-8-7-9-14(2)16(13)17(19)15(3)12-18-10-5-4-6-11-18/h7-9,15H,4-6,10-12H2,1-3H3
InChIKey UKJUFRCYOPICDD-UHFFFAOYSA-N
Molecular Weight 259.393 g/mol
SMILES C1(=C(C=CC=C1C)C)C(C(CN1CCCCC1)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.866232