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(6Z)-6-benzylidene-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
SpectraBase Compound ID CHU5Ye3rLqi
InChI InChI=1S/C13H10N4OS2/c1-19-13-16-20-12-15-11(18)9(10(14)17(12)13)7-8-5-3-2-4-6-8/h2-7,14H,1H3/b9-7-,14-10?
InChIKey JOEJGNKFSKNTIW-XHOBBRPJSA-N
Mol Weight 302.37 g/mol
Molecular Formula C13H10N4OS2
Exact Mass 302.029603 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ByeVIPFfebd
Name (6Z)-6-benzylidene-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-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 302.029603305 u
Formula C13H10N4OS2
InChI InChI=1S/C13H10N4OS2/c1-19-13-16-20-12-15-11(18)9(10(14)17(12)13)7-8-5-3-2-4-6-8/h2-7,14H,1H3/b9-7-,14-10?
InChIKey JOEJGNKFSKNTIW-XHOBBRPJSA-N
Molecular Weight 302.370 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_144
Solvent DMSO-d6
Source Vendor ID: NMR/12259801