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1-(4,4-Dimethyl-1-phenylpent-1-yn-3-yl)piperidine

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

1-(4,4-Dimethyl-1-phenylpent-1-yn-3-yl)piperidine
SpectraBase Compound ID ASLQxQpxIM2
InChI InChI=1S/C18H25N/c1-18(2,3)17(19-14-8-5-9-15-19)13-12-16-10-6-4-7-11-16/h4,6-7,10-11,17H,5,8-9,14-15H2,1-3H3
InChIKey ROSXRVWVYPXOBC-UHFFFAOYSA-N
Mol Weight 255.4 g/mol
Molecular Formula C18H25N
Exact Mass 255.1987 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2fhQXcp73my
Name 1-(4,4-Dimethyl-1-phenylpent-1-yn-3-yl)piperidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.198699809 u
Formula C18H25N
InChI InChI=1S/C18H25N/c1-18(2,3)17(19-14-8-5-9-15-19)13-12-16-10-6-4-7-11-16/h4,6-7,10-11,17H,5,8-9,14-15H2,1-3H3
InChIKey ROSXRVWVYPXOBC-UHFFFAOYSA-N
Molecular Weight 255.405 g/mol
SMILES C(C)(C)(C(C#CC1=CC=CC=C1)N1CCCCC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963615