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1-(3,3-dimethyl-2-oxobutyl)-3-methyl-2-propyl-3H-benzimidazol-1-ium bromide
SpectraBase Compound ID ACFGPNRvQ3G
InChI InChI=1S/C17H25N2O.BrH/c1-6-9-16-18(5)13-10-7-8-11-14(13)19(16)12-15(20)17(2,3)4;/h7-8,10-11H,6,9,12H2,1-5H3;1H/q+1;/p-1
InChIKey FATVDQQSRMTVFN-UHFFFAOYSA-M
Mol Weight 353.3 g/mol
Molecular Formula C17H25BrN2O
Exact Mass 352.115026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9fG2qDR4DjH
Name 1-(3,3-dimethyl-2-oxobutyl)-3-methyl-2-propyl-3H-benzimidazol-1-ium 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/C17H25N2O.BrH/c1-6-9-16-18(5)13-10-7-8-11-14(13)19(16)12-15(20)17(2,3)4;/h7-8,10-11H,6,9,12H2,1-5H3;1H/q+1;/p-1
InChIKey FATVDQQSRMTVFN-UHFFFAOYSA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17402
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: 987/00005490; Labnumber: 987/00005490218867; VK_ID: VK-017407
Temperature 318 °C