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1-[4-(Trifluoromethoxy)benzyl]piperazine

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

1-[4-(Trifluoromethoxy)benzyl]piperazine
SpectraBase Compound ID 3KISzSdkfDF
InChI InChI=1S/C12H15F3N2O/c13-12(14,15)18-11-3-1-10(2-4-11)9-17-7-5-16-6-8-17/h1-4,16H,5-9H2
InChIKey YYHAJSIKVDIQNW-UHFFFAOYSA-N
Mol Weight 260.26 g/mol
Molecular Formula C12H15F3N2O
Exact Mass 260.113648 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3XPDvOd3thQ
Name 1-[4-(Trifluoromethoxy)benzyl]piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.113647599 u
Formula C12H15F3N2O
InChI InChI=1S/C12H15F3N2O/c13-12(14,15)18-11-3-1-10(2-4-11)9-17-7-5-16-6-8-17/h1-4,16H,5-9H2
InChIKey YYHAJSIKVDIQNW-UHFFFAOYSA-N
Molecular Weight 260.260 g/mol
SMILES C(F)(F)(F)OC1=CC=C(C=C1)CN1CCNCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.908985