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1-Hexyl-4-(3,4-methylenedioxyphenyl)piperazine

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

1-Hexyl-4-(3,4-methylenedioxyphenyl)piperazine
SpectraBase Compound ID 2WgwoXbYu0P
InChI InChI=1S/C18H28N2O2/c1-2-3-4-5-8-19-9-11-20(12-10-19)14-16-6-7-17-18(13-16)22-15-21-17/h6-7,13H,2-5,8-12,14-15H2,1H3
InChIKey PYHZPDWYSXLJSN-UHFFFAOYSA-N
Mol Weight 304.43 g/mol
Molecular Formula C18H28N2O2
Exact Mass 304.215078 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BfeKrOgTcIJ
Name 1-Hexyl-4-(3,4-methylenedioxyphenyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.215078148 u
Formula C18H28N2O2
InChI InChI=1S/C18H28N2O2/c1-2-3-4-5-8-19-9-11-20(12-10-19)14-16-6-7-17-18(13-16)22-15-21-17/h6-7,13H,2-5,8-12,14-15H2,1H3
InChIKey PYHZPDWYSXLJSN-UHFFFAOYSA-N
SMILES C=12C(=CC(CN3CCN(CC3)CCCCCC)=CC1)OCO2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873626