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(6Z)-6-(4-bromobenzylidene)-5-imino-2-(4-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID HlYseRhDZIK
InChI InChI=1S/C19H13BrN4OS/c1-11-2-6-13(7-3-11)18-23-24-16(21)15(17(25)22-19(24)26-18)10-12-4-8-14(20)9-5-12/h2-10,21H,1H3/b15-10-,21-16?
InChIKey MLMOHJZBLQOFJI-ACXWOISZSA-N
Mol Weight 425.3 g/mol
Molecular Formula C19H13BrN4OS
Exact Mass 423.999345 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D414snZu803
Name (6Z)-6-(4-bromobenzylidene)-5-imino-2-(4-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-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/C19H13BrN4OS/c1-11-2-6-13(7-3-11)18-23-24-16(21)15(17(25)22-19(24)26-18)10-12-4-8-14(20)9-5-12/h2-10,21H,1H3/b15-10-,21-16?
InChIKey MLMOHJZBLQOFJI-ACXWOISZSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6238
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: 62709; UBI_ID: UBI-006240
Synonyms 6-(4-bromobenzylidene)-5-imino-2-(4-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 308 °C