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(6Z)-6-{3-bromo-4-[2-(4-methylphenoxy)ethoxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID DNybVWI7mtL
InChI InChI=1S/C22H18BrN3O3S/c1-14-2-5-16(6-3-14)28-9-10-29-19-7-4-15(13-18(19)23)12-17-20(24)26-8-11-30-22(26)25-21(17)27/h2-8,11-13,24H,9-10H2,1H3/b17-12-,24-20?
InChIKey ZZDAOGBJMYFMEJ-WPTKKBASSA-N
Mol Weight 484.37 g/mol
Molecular Formula C22H18BrN3O3S
Exact Mass 483.025226 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5U2vPmAzkQI
Name (6Z)-6-{3-bromo-4-[2-(4-methylphenoxy)ethoxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 483.025225623 u
Formula C22H18BrN3O3S
InChI InChI=1S/C22H18BrN3O3S/c1-14-2-5-16(6-3-14)28-9-10-29-19-7-4-15(13-18(19)23)12-17-20(24)26-8-11-30-22(26)25-21(17)27/h2-8,11-13,24H,9-10H2,1H3/b17-12-,24-20?
InChIKey ZZDAOGBJMYFMEJ-WPTKKBASSA-N
Molecular Weight 484.368 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_113
Solvent DMSO-d6
Source Vendor ID: NMR/12259770