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(6Z)-5-imino-3-(methylsulfanyl)-6-[4-(methylsulfanyl)benzylidene]-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
SpectraBase Compound ID 8xsZAN1YQf4
InChI InChI=1S/C14H12N4OS3/c1-20-9-5-3-8(4-6-9)7-10-11(15)18-13(16-12(10)19)22-17-14(18)21-2/h3-7,15H,1-2H3/b10-7-,15-11?
InChIKey ZRPKFTOEHHMZFF-DDADGOEASA-N
Mol Weight 348.46 g/mol
Molecular Formula C14H12N4OS3
Exact Mass 348.017325 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H4a7Jg11Fte
Name (6Z)-5-imino-3-(methylsulfanyl)-6-[4-(methylsulfanyl)benzylidene]-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 348.017324543 u
Formula C14H12N4OS3
InChI InChI=1S/C14H12N4OS3/c1-20-9-5-3-8(4-6-9)7-10-11(15)18-13(16-12(10)19)22-17-14(18)21-2/h3-7,15H,1-2H3/b10-7-,15-11?
InChIKey ZRPKFTOEHHMZFF-DDADGOEASA-N
Molecular Weight 348.457 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_166
Solvent DMSO-d6
Source Vendor ID: NMR/12259824