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2,6-Diamino-4-(3-iodophenyl)-4H-thiopyran-3,5-dicarbonitrile
SpectraBase Compound ID 2ufsGONBq7F
InChI InChI=1S/C13H9IN4S/c14-8-3-1-2-7(4-8)11-9(5-15)12(17)19-13(18)10(11)6-16/h1-4,11H,17-18H2
InChIKey HHORIXLYBARJKW-UHFFFAOYSA-N
Mol Weight 380.21 g/mol
Molecular Formula C13H9IN4S
Exact Mass 379.959262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3IUVazNn0Z7
Name 2,6-Diamino-4-(3-iodophenyl)-4H-thiopyran-3,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9IN4S
InChI InChI=1S/C13H9IN4S/c14-8-3-1-2-7(4-8)11-9(5-15)12(17)19-13(18)10(11)6-16/h1-4,11H,17-18H2
InChIKey HHORIXLYBARJKW-UHFFFAOYSA-N
Molecular Weight 380.207 g/mol
SMILES NC1=C(C(C(=C(S1)N)C#N)c1cc(ccc1)I)C#N
SPLASH splash10-004i-9700000000-45c18d279b7de58e4dca
Synonyms 2,6-bis(azanyl)-4-(3-iodanylphenyl)-4H-thiopyran-3,5-dicarbonitrile
Wiley ID 1451208