For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(3-Chlorophenyl)piperazine TFA
SpectraBase Compound ID 92SXBkxAvbi
InChI InChI=1S/C12H12ClF3N2O/c13-9-2-1-3-10(8-9)17-4-6-18(7-5-17)11(19)12(14,15)16/h1-3,8H,4-7H2
InChIKey MGTQGGKCNWVZDD-UHFFFAOYSA-N
Mol Weight 292.69 g/mol
Molecular Formula C12H12ClF3N2O
Exact Mass 292.059025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5VjGu3ENcm0
Name 1-(3-Chlorophenyl)piperazine TFA
CAS Registry Number 3798-91-2
Classification Piperazine derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 292.059025202 u
Formula C12H12ClF3N2O
InChI InChI=1S/C12H12ClF3N2O/c13-9-2-1-3-10(8-9)17-4-6-18(7-5-17)11(19)12(14,15)16/h1-3,8H,4-7H2
InChIKey MGTQGGKCNWVZDD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 292.689 g/mol
Nominal Mass 292 u
Quality 914
Retention Index 1945
SMILES C(N1CCN(C=2C=C(C=CC2)Cl)CC1)(C(F)(F)F)=O
SPLASH splash10-00kf-1930000000-804f2576f9a76466277f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Nefadazone-M TFA Trazodone-M TFA 1-(4-(3-chlorophenyl)piperazin-1-yl)-2,2,2-trifluoroethan-1-one
Technique GC/MS
Wiley ID DD2024_012153