(3E)-3-Bromo-1,1,1-trifluoro-4-[(4-fluorophenyl)amino]-3-buten-2-one

ChemSpider ID: 21807415
Molecular Formula: C10H6BrF4NO
Average mass: 312.058014 Da
Monoisotopic mass: 310.957001 Da
Systematic name

(3E)-3-Bromo-1,1,1-trifluoro-4-[(4-fluorophenyl)amino]-3-buten-2-one
SMILES and InChIs

SMILES:

c1cc(ccc1NC=C(C(=O)C(F)(F)F)Br)F Copied

Std. InChI:

InChI=1S/C10H6BrF4NO/c11-8(9(17)10(13,14)15)5-16-7-3-1-6(12)2-4-7/h1-5,16H/b8-5+ Copied

Std. InChIKey:

CJAXFZFBXOTSKW-VMPITWQZSA-N Copied
Cite this record
CSID:21807415, http://www.chemspider.com/Chemical-Structure.21807415.html (accessed 05:27, May 25, 2012) Copied

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

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