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1-[3-(3-bromoanilino)-3-oxopropyl]-4-methylpiperazinediium

View entire compound with spectra: 1 NMR

1-[3-(3-bromoanilino)-3-oxopropyl]-4-methylpiperazinediium
SpectraBase Compound ID DR2kqpTy2K7
InChI InChI=1S/C14H20BrN3O/c1-17-7-9-18(10-8-17)6-5-14(19)16-13-4-2-3-12(15)11-13/h2-4,11H,5-10H2,1H3,(H,16,19)/p+2
InChIKey PMDWIEBTNRBTOF-UHFFFAOYSA-P
Mol Weight 328.25 g/mol
Molecular Formula C14H22BrN3O
Exact Mass 327.094625 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Erbdt0frfrL
Name 1-[3-(3-bromoanilino)-3-oxopropyl]-4-methylpiperazinediium
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/C14H20BrN3O/c1-17-7-9-18(10-8-17)6-5-14(19)16-13-4-2-3-12(15)11-13/h2-4,11H,5-10H2,1H3,(H,16,19)/p+2
InChIKey PMDWIEBTNRBTOF-UHFFFAOYSA-P
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10553
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: UZI/9072454; UBI_ID: UBI-010556
Temperature 308 °C