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2-hydroxy-1-phenyl-2-(2-thienyl)-1H,2H,3H,5H,6H,7H,8H,9H-imidazo[1,2-a]azepin-4-ium bromide
SpectraBase Compound ID 2rGiIlQ2f9d
InChI InChI=1S/C18H21N2OS.BrH/c21-18(16-10-7-13-22-16)14-19-12-6-2-5-11-17(19)20(18)15-8-3-1-4-9-15;/h1,3-4,7-10,13,21H,2,5-6,11-12,14H2;1H/q+1;/p-1
InChIKey IZONDTJWNOTQJO-UHFFFAOYSA-M
Mol Weight 393.34 g/mol
Molecular Formula C18H21BrN2OS
Exact Mass 392.055797 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EtVmngOpoSE
Name 2-hydroxy-1-phenyl-2-(2-thienyl)-1H,2H,3H,5H,6H,7H,8H,9H-imidazo[1,2-a]azepin-4-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/C18H21N2OS.BrH/c21-18(16-10-7-13-22-16)14-19-12-6-2-5-11-17(19)20(18)15-8-3-1-4-9-15;/h1,3-4,7-10,13,21H,2,5-6,11-12,14H2;1H/q+1;/p-1
InChIKey IZONDTJWNOTQJO-UHFFFAOYSA-M
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17378
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: 987/00005440; Labnumber: 987/00005440218866; VK_ID: VK-017383
Temperature 308 °C