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5-Amino-1-keto-7-phenyl-3-thioxo-pyrrol[1,2-c]imidazole-6-carbonitrile
SpectraBase Compound ID JqE1xI4pe0W
InChI InChI=1S/C13H8N4OS/c14-6-8-9(7-4-2-1-3-5-7)10-12(18)16-13(19)17(10)11(8)15/h1-5H,15H2,(H,16,18,19)
InChIKey PYLUETYDKHUFRE-UHFFFAOYSA-N
Mol Weight 268.29 g/mol
Molecular Formula C13H8N4OS
Exact Mass 268.041882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J18oOP1JSA2
Name 5-Amino-1-keto-7-phenyl-3-thioxo-pyrrol[1,2-c]imidazole-6-carbonitrile
Alternate Name(s) 5-Amino-1-oxo-7-phenyl-3-sulfanylidene-6-pyrrolo[1,2-c]imidazolecarbonitrile 5-Amino-1-oxo-7-phenyl-3-sulfanylidenepyrrolo[1,2-c]imidazole-6-carbonitrile 5-Amino-1-oxo-7-phenyl-3-thioxo-pyrrolo[1,2-c]imidazole-6-carbonitrile 5-Azanyl-1-oxidanylidene-7-phenyl-3-sulfanylidene-pyrrolo[1,2-c]imidazole-6-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8N4OS
InChI InChI=1S/C13H8N4OS/c14-6-8-9(7-4-2-1-3-5-7)10-12(18)16-13(19)17(10)11(8)15/h1-5H,15H2,(H,16,18,19)
InChIKey PYLUETYDKHUFRE-UHFFFAOYSA-N
Molecular Weight 268.294 g/mol
SMILES N1C(c2[n](c(c(c2-c2ccccc2)C#N)N)C1=S)=O
SPLASH splash10-067i-0490000000-9b5a98150c6fb8d5cba2
Source of Spectrum Y-39-252-20
Wiley ID 1528352