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N-Benzyl-4-cyclopentyl-1-piperazinecarboxamide, N-methyl
SpectraBase Compound ID 80VrdVv22qS
InChI InChI=1S/C18H27N3O/c1-19(15-16-7-3-2-4-8-16)18(22)21-13-11-20(12-14-21)17-9-5-6-10-17/h2-4,7-8,17H,5-6,9-15H2,1H3
InChIKey PGIBFWDIAXZULD-UHFFFAOYSA-N
Mol Weight 301.43 g/mol
Molecular Formula C18H27N3O
Exact Mass 301.215413 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IglWI6yaMOt
Name N-Benzyl-4-cyclopentyl-1-piperazinecarboxamide, N-methyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.215412500 u
Formula C18H27N3O
InChI InChI=1S/C18H27N3O/c1-19(15-16-7-3-2-4-8-16)18(22)21-13-11-20(12-14-21)17-9-5-6-10-17/h2-4,7-8,17H,5-6,9-15H2,1H3
InChIKey PGIBFWDIAXZULD-UHFFFAOYSA-N
SMILES C1N(CCN(C1)C1CCCC1)C(=O)N(CC1=CC=CC=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.883252