(E)-[Amino(ammonio)methylene](3-iodobenzyl)ammonium sulfate

ChemSpider ID: 2018304
Molecular Formula: C₈H₁₂IN₃O₄S
Average mass: 373.168091 Da
Monoisotopic mass: 372.95932 Da
Systematic name

(E)-[Amino(ammonio)methylene](3-iodobenzyl)ammonium sulfate
SMILES and InChIs

SMILES:

Ic1cc(ccc1)C/[NH+]=C(\N)[NH3+].[O-]S([O-])(=O)=O Copied

Std. InChI:

InChI=1S/C8H10IN3.H2O4S/c9-7-3-1-2-6(4-7)5-12-8(10)11;1-5(2,3)4/h1-4H,5H2,(H4,10,11,12);(H2,1,2,3,4) Copied

Std. InChIKey:

NMHJRGCKGFRFAQ-UHFFFAOYSA-N Copied
Cite this record
CSID:2018304, http://www.chemspider.com/Chemical-Structure.2018304.html (accessed 23:27, May 24, 2012) Copied

Names and Identifiers

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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