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3-(4-chlorophenyl)-1-[2-(4-ethylphenyl)-2-oxoethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium bromide
SpectraBase Compound ID LtbJnpziEoU
InChI InChI=1S/C22H22ClN2O.BrH/c1-2-16-5-7-18(8-6-16)21(26)15-24-14-20(25-13-3-4-22(24)25)17-9-11-19(23)12-10-17;/h5-12,14H,2-4,13,15H2,1H3;1H/q+1;/p-1
InChIKey XOVWGTRMZSYCCT-UHFFFAOYSA-M
Mol Weight 445.79 g/mol
Molecular Formula C22H22BrClN2O
Exact Mass 444.060404 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D3gvxeygcAt
Name 3-(4-chlorophenyl)-1-[2-(4-ethylphenyl)-2-oxoethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-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/C22H22ClN2O.BrH/c1-2-16-5-7-18(8-6-16)21(26)15-24-14-20(25-13-3-4-22(24)25)17-9-11-19(23)12-10-17;/h5-12,14H,2-4,13,15H2,1H3;1H/q+1;/p-1
InChIKey XOVWGTRMZSYCCT-UHFFFAOYSA-M
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28476
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: D87885; Labnumber: SC_0087-1022; SBI_ID: SBI-028480
Temperature 318 °C