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1-Ethyl-4-(4-nitrophenyl)piperazine

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

1-Ethyl-4-(4-nitrophenyl)piperazine
SpectraBase Compound ID 7VVVJav1v5I
InChI InChI=1S/C12H17N3O2/c1-2-13-7-9-14(10-8-13)11-3-5-12(6-4-11)15(16)17/h3-6H,2,7-10H2,1H3
InChIKey XEWICNRVCQLKIG-UHFFFAOYSA-N
Mol Weight 235.29 g/mol
Molecular Formula C12H17N3O2
Exact Mass 235.132077 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3YVb4NzQtgL
Name 1-Ethyl-4-(4-nitrophenyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.132076797 u
Formula C12H17N3O2
InChI InChI=1S/C12H17N3O2/c1-2-13-7-9-14(10-8-13)11-3-5-12(6-4-11)15(16)17/h3-6H,2,7-10H2,1H3
InChIKey XEWICNRVCQLKIG-UHFFFAOYSA-N
Molecular Weight 235.287 g/mol
SMILES C=1(N2CCN(CC2)CC)C=CC(=CC1)[N+](=O)[O-]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92937