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4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)-1-[2-(4-methoxyphenyl)-2-oxoethyl]pyridinium bromide
SpectraBase Compound ID IfV3fqBAq1B
InChI InChI=1S/C19H19N4O2.BrH/c1-25-16-6-4-14(5-7-16)17(24)13-22-11-8-15(9-12-22)19-21-20-18-3-2-10-23(18)19;/h4-9,11-12H,2-3,10,13H2,1H3;1H/q+1;/p-1
InChIKey CCJVJCMODDXGDN-UHFFFAOYSA-M
Mol Weight 415.29 g/mol
Molecular Formula C19H19BrN4O2
Exact Mass 414.069139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 36F7XJNbWZT
Name 4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)-1-[2-(4-methoxyphenyl)-2-oxoethyl]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/C19H19N4O2.BrH/c1-25-16-6-4-14(5-7-16)17(24)13-22-11-8-15(9-12-22)19-21-20-18-3-2-10-23(18)19;/h4-9,11-12H,2-3,10,13H2,1H3;1H/q+1;/p-1
InChIKey CCJVJCMODDXGDN-UHFFFAOYSA-M
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_6015
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: 121939; Labnumber: EX00112474; VK_ID: VK-006018
Temperature 308 °C