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(7Z)-7-(3-bromobenzylidene)-3-(3-chloro-4-methylphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
SpectraBase Compound ID GCD07zEnq4J
InChI InChI=1S/C19H15BrClN3OS/c1-12-5-6-15(9-16(12)21)23-10-22-19-24(11-23)18(25)17(26-19)8-13-3-2-4-14(20)7-13/h2-9H,10-11H2,1H3/b17-8-
InChIKey ITTHFZADWNLQOR-IUXPMGMMSA-N
Mol Weight 448.77 g/mol
Molecular Formula C19H15BrClN3OS
Exact Mass 446.980774 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3HfVeSSWkn4
Name (7Z)-7-(3-bromobenzylidene)-3-(3-chloro-4-methylphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
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/C19H15BrClN3OS/c1-12-5-6-15(9-16(12)21)23-10-22-19-24(11-23)18(25)17(26-19)8-13-3-2-4-14(20)7-13/h2-9H,10-11H2,1H3/b17-8-
InChIKey ITTHFZADWNLQOR-IUXPMGMMSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_882
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: C74956; Labnumber: RRKU-2065; SBI_ID: SBI-000884
Synonyms 7-(3-bromobenzylidene)-3-(3-chloro-4-methylphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Temperature 308 °C