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quinolinium, 2-[(Z)-(3-ethyl-6-methyl-2(3H)-benzothiazolylidene)methyl]-1-(2-hydroxyethyl)-, iodide
SpectraBase Compound ID 4QMtPHQgmHk
InChI InChI=1S/C22H23N2OS.HI/c1-3-23-20-11-8-16(2)14-21(20)26-22(23)15-18-10-9-17-6-4-5-7-19(17)24(18)12-13-25;/h4-11,14-15,25H,3,12-13H2,1-2H3;1H/q+1;/p-1
InChIKey GLCMSQWNWFTJMQ-UHFFFAOYSA-M
Mol Weight 490.4 g/mol
Molecular Formula C22H23IN2OS
Exact Mass 490.05758 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID By67IXIWsIf
Name quinolinium, 2-[(Z)-(3-ethyl-6-methyl-2(3H)-benzothiazolylidene)methyl]-1-(2-hydroxyethyl)-, iodide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 490.057579542 u
Formula C22H23IN2OS
InChI InChI=1S/C22H23N2OS.HI/c1-3-23-20-11-8-16(2)14-21(20)26-22(23)15-18-10-9-17-6-4-5-7-19(17)24(18)12-13-25;/h4-11,14-15,25H,3,12-13H2,1-2H3;1H/q+1;/p-1
InChIKey GLCMSQWNWFTJMQ-UHFFFAOYSA-M
Molecular Weight 490.403 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7714
Solvent DMSO-d6
Source Vendor ID: NMR/13308526