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1-Phenylpiperazine, N-hfb

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

1-Phenylpiperazine, N-hfb
SpectraBase Compound ID 9DniIRrISkq
InChI InChI=1S/C14H13F7N2O/c15-12(16,13(17,18)14(19,20)21)11(24)23-8-6-22(7-9-23)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKey UIPQZQRACZEVPW-UHFFFAOYSA-N
Mol Weight 358.26 g/mol
Molecular Formula C14H13F7N2O
Exact Mass 358.09161 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5mlVXa0J4Ev
Name 1-Phenylpiperazine, N-hfb
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.091610187 u
Formula C14H13F7N2O
InChI InChI=1S/C14H13F7N2O/c15-12(16,13(17,18)14(19,20)21)11(24)23-8-6-22(7-9-23)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKey UIPQZQRACZEVPW-UHFFFAOYSA-N
Molecular Weight 358.260 g/mol
SMILES C1(=CC=CC=C1)N1CCN(CC1)C(C(F)(F)C(F)(F)C(F)(F)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.80635