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piperazinediium, 1-[2-[[4-(chlorodifluoromethoxy)phenyl]amino]-2-oxoethyl]-4-(2-hydroxyethyl)-, dichloride
SpectraBase Compound ID HnX53DRtHJZ
InChI InChI=1S/C15H20ClF2N3O3.2ClH/c16-15(17,18)24-13-3-1-12(2-4-13)19-14(23)11-21-7-5-20(6-8-21)9-10-22;;/h1-4,22H,5-11H2,(H,19,23);2*1H
InChIKey IZRCAOFZOFXQAZ-UHFFFAOYSA-N
Mol Weight 436.71 g/mol
Molecular Formula C15H22Cl3F2N3O3
Exact Mass 435.069481 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1wXWPWXUYjJ
Name piperazinediium, 1-[2-[[4-(chlorodifluoromethoxy)phenyl]amino]-2-oxoethyl]-4-(2-hydroxyethyl)-, dichloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.069481003 u
Formula C15H22Cl3F2N3O3
InChI InChI=1S/C15H20ClF2N3O3.2ClH/c16-15(17,18)24-13-3-1-12(2-4-13)19-14(23)11-21-7-5-20(6-8-21)9-10-22;;/h1-4,22H,5-11H2,(H,19,23);2*1H
InChIKey IZRCAOFZOFXQAZ-UHFFFAOYSA-N
Molecular Weight 436.715 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13347
Solvent DMSO-d6
Source Vendor ID: NMR/10260449; Lab Info: KTS; Lab Number: KTS-0000036