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3-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium bromide
SpectraBase Compound ID 1OQtuDNN1Uz
InChI InChI=1S/C20H23N2O3S.BrH/c1-24-17-10-9-15(13-18(17)25-2)20(23)14-21(16-7-4-3-5-8-16)19-22(20)11-6-12-26-19;/h3-5,7-10,13,23H,6,11-12,14H2,1-2H3;1H/q+1;/p-1
InChIKey NDGVBWVFXXCROZ-UHFFFAOYSA-M
Mol Weight 451.38 g/mol
Molecular Formula C20H23BrN2O3S
Exact Mass 450.061277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IuGUHoYMOFD
Name 3-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-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/C20H23N2O3S.BrH/c1-24-17-10-9-15(13-18(17)25-2)20(23)14-21(16-7-4-3-5-8-16)19-22(20)11-6-12-26-19;/h3-5,7-10,13,23H,6,11-12,14H2,1-2H3;1H/q+1;/p-1
InChIKey NDGVBWVFXXCROZ-UHFFFAOYSA-M
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5934
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: 121838; Labnumber: EX00112219; VK_ID: VK-005937
Temperature 308 °C