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1,4-piperazinediacetamide, N~1~-(3-chloro-4-methoxyphenyl)-N~4~-(4-fluorophenyl)-
SpectraBase Compound ID F9Y5mvkuXKI
InChI InChI=1S/C21H24ClFN4O3/c1-30-19-7-6-17(12-18(19)22)25-21(29)14-27-10-8-26(9-11-27)13-20(28)24-16-4-2-15(23)3-5-16/h2-7,12H,8-11,13-14H2,1H3,(H,24,28)(H,25,29)
InChIKey DHLOIEFTJWFLKQ-UHFFFAOYSA-N
Mol Weight 434.9 g/mol
Molecular Formula C21H24ClFN4O3
Exact Mass 434.152097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JSqFC6mRc1d
Name 1,4-piperazinediacetamide, N~1~-(3-chloro-4-methoxyphenyl)-N~4~-(4-fluorophenyl)-
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/C21H24ClFN4O3/c1-30-19-7-6-17(12-18(19)22)25-21(29)14-27-10-8-26(9-11-27)13-20(28)24-16-4-2-15(23)3-5-16/h2-7,12H,8-11,13-14H2,1H3,(H,24,28)(H,25,29)
InChIKey DHLOIEFTJWFLKQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6154
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/12219809