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2,6-DIAMINO-4-PHENYL-4H-THIOPYRAN-3,5-DICARBONITRILE

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2,6-DIAMINO-4-PHENYL-4H-THIOPYRAN-3,5-DICARBONITRILE
SpectraBase Compound ID BjD6jpc60Ej
InChI InChI=1S/C13H10N4S/c14-6-9-11(8-4-2-1-3-5-8)10(7-15)13(17)18-12(9)16/h1-5,11H,16-17H2
InChIKey JAMKVNSBEKQPQS-UHFFFAOYSA-N
Mol Weight 254.31 g/mol
Molecular Formula C13H10N4S
Exact Mass 254.062618 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVRnWKuodHg
Name 2,6-DIAMINO-4-PHENYL-4H-THIOPYRAN-3,5-DICARBONITRILE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10N4S
InChI InChI=1S/C13H10N4S/c14-6-9-11(8-4-2-1-3-5-8)10(7-15)13(17)18-12(9)16/h1-5,11H,16-17H2
InChIKey JAMKVNSBEKQPQS-UHFFFAOYSA-N
Literature Reference Author N.M.H.ELNAGDI,N.S.A.HOKBANY
Literature Reference Citation MOLECULES,17,4300(2012)
Literature Reference DOI 10.3390/molecules17044300
Molecular Weight 254.309 g/mol
Sample ID 1721
Solvent DMSO-D6