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1-[2-(3,4-dichlorophenyl)-2-oxoethyl]-4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)pyridinium bromide
SpectraBase Compound ID 37y4PkGJPLm
InChI InChI=1S/C18H15Cl2N4O.BrH/c19-14-4-3-13(10-15(14)20)16(25)11-23-8-5-12(6-9-23)18-22-21-17-2-1-7-24(17)18;/h3-6,8-10H,1-2,7,11H2;1H/q+1;/p-1
InChIKey LCGRMTKTIXZAQX-UHFFFAOYSA-M
Mol Weight 454.16 g/mol
Molecular Formula C18H15BrCl2N4O
Exact Mass 451.98063 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6ffhEtAOsUE
Name 1-[2-(3,4-dichlorophenyl)-2-oxoethyl]-4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)pyridinium bromide
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/C18H15Cl2N4O.BrH/c19-14-4-3-13(10-15(14)20)16(25)11-23-8-5-12(6-9-23)18-22-21-17-2-1-7-24(17)18;/h3-6,8-10H,1-2,7,11H2;1H/q+1;/p-1
InChIKey LCGRMTKTIXZAQX-UHFFFAOYSA-M
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_6022
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: 121948; Labnumber: EX00112487; VK_ID: VK-006025
Temperature 308 °C