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piperazinediium, 1-[3-(1,3-benzodioxol-5-ylamino)-3-oxopropyl]-4-ethyl-, dichloride
SpectraBase Compound ID 7yH4HgtzKaq
InChI InChI=1S/C16H23N3O3.2ClH/c1-2-18-7-9-19(10-8-18)6-5-16(20)17-13-3-4-14-15(11-13)22-12-21-14;;/h3-4,11H,2,5-10,12H2,1H3,(H,17,20);2*1H
InChIKey YPRWGPWLHAONLE-UHFFFAOYSA-N
Mol Weight 378.3 g/mol
Molecular Formula C16H25Cl2N3O3
Exact Mass 377.127297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H8t64kTJXx3
Name piperazinediium, 1-[3-(1,3-benzodioxol-5-ylamino)-3-oxopropyl]-4-ethyl-, dichloride
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/C16H23N3O3.2ClH/c1-2-18-7-9-19(10-8-18)6-5-16(20)17-13-3-4-14-15(11-13)22-12-21-14;;/h3-4,11H,2,5-10,12H2,1H3,(H,17,20);2*1H
InChIKey YPRWGPWLHAONLE-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2694
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/11248157