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piperazinium, 1-(2-chloroethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]-, chloride

View entire compound with spectra: 1 NMR

piperazinium, 1-(2-chloroethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]-, chloride
SpectraBase Compound ID EUSjrTfUAp5
InChI InChI=1S/C13H15ClF3N3O2.ClH/c14-3-4-18-5-7-19(8-6-18)11-2-1-10(13(15,16)17)9-12(11)20(21)22;/h1-2,9H,3-8H2;1H
InChIKey PTOBMUIEOIDCIV-UHFFFAOYSA-N
Mol Weight 374.19 g/mol
Molecular Formula C13H16Cl2F3N3O2
Exact Mass 373.057167 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 744nT6flgAT
Name piperazinium, 1-(2-chloroethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]-, chloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H15ClF3N3O2.ClH/c14-3-4-18-5-7-19(8-6-18)11-2-1-10(13(15,16)17)9-12(11)20(21)22;/h1-2,9H,3-8H2;1H
InChIKey PTOBMUIEOIDCIV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6947
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/10322483; Labnumber: LP-2101759