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4-(4-(4-Methylpiperazin-1-yl)piperidin-1-yl)aniline, N-acetyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

4-(4-(4-Methylpiperazin-1-yl)piperidin-1-yl)aniline, N-acetyl-
SpectraBase Compound ID 6VcslO0w7xy
InChI InChI=1S/C18H28N4O/c1-15(23)19-16-3-5-17(6-4-16)21-9-7-18(8-10-21)22-13-11-20(2)12-14-22/h3-6,18H,7-14H2,1-2H3,(H,19,23)
InChIKey UFBCQXPNQPTTCD-UHFFFAOYSA-N
Mol Weight 316.45 g/mol
Molecular Formula C18H28N4O
Exact Mass 316.226312 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9PTxy2udYB7
Name 4-(4-(4-Methylpiperazin-1-yl)piperidin-1-yl)aniline, N-acetyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.226311537 u
Formula C18H28N4O
InChI InChI=1S/C18H28N4O/c1-15(23)19-16-3-5-17(6-4-16)21-9-7-18(8-10-21)22-13-11-20(2)12-14-22/h3-6,18H,7-14H2,1-2H3,(H,19,23)
InChIKey UFBCQXPNQPTTCD-UHFFFAOYSA-N
Molecular Weight 316.449 g/mol
SMILES C1N(CCN(C1)C)C1CCN(CC1)C1=CC=C(C=C1)NC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913154