1-Benzyl-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]pyrrolidine-2-carboxamide

SpectraBase Compound ID	FTH55bCv9R8
InChI	InChI=1S/C26H36N4O2/c1-32-25-13-6-5-11-23(25)29-19-17-28(18-20-29)15-8-14-27-26(31)24-12-7-16-30(24)21-22-9-3-2-4-10-22/h2-6,9-11,13,24H,7-8,12,14-21H2,1H3,(H,27,31)
InChIKey	IELHQMRHJDKWJJ-UHFFFAOYSA-N Google Search
Mol Weight	436.6 g/mol
Molecular Formula	C26H36N4O2
Exact Mass	436.283826 g/mol

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SpectraBase Spectrum ID	2egh3EeaYf
Name	1-Benzyl-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]pyrrolidine-2-carboxamide
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	436.283826413 u
Formula	C26H36N4O2
InChI	InChI=1S/C26H36N4O2/c1-32-25-13-6-5-11-23(25)29-19-17-28(18-20-29)15-8-14-27-26(31)24-12-7-16-30(24)21-22-9-3-2-4-10-22/h2-6,9-11,13,24H,7-8,12,14-21H2,1H3,(H,27,31)
InChIKey	IELHQMRHJDKWJJ-UHFFFAOYSA-N
Molecular Weight	436.600 g/mol
SMILES	C1(N(CCC1)CC=1C=CC=CC1)C(=O)NCCCN1CCN(CC1)C=1C(OC)=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.95443