Want to comment
on this record?

1-(2-Isocyanoethyl)-4-methoxybenzene - (⁹⁹Tc)technetium (6:1)

ChemSpider ID: 396248
Molecular Formula: C₆₀H₆₆N₆O₆⁹⁹Tc
Average mass: 1066.108887 Da
Monoisotopic mass: 1065.410645 Da
Systematic name

1-(2-Isocyanoethyl)-4-methoxybenzene - (⁹⁹Tc)technetium (6:1)
SMILES and InChIs

SMILES:

COc1ccc(cc1)CC[N+]#[C-].COc1ccc(cc1)CC[N+]#[C-].COc1ccc(cc1)CC[N+]#[C-].COc1ccc(cc1)CC[N+]#[C-].COc1ccc(cc1)CC[N+]#[C-].COc1ccc(cc1)CC[N+]#[C-].[Tc] Copied

Std. InChI:

InChI=1S/6C10H11NO.Tc/c6*1-11-8-7-9-3-5-10(12-2)6-4-9;/h6*3-6H,7-8H2,2H3;/i;;;;;;1+1 Copied

Std. InChIKey:

LCRFYFHQZUFQCL-KTTJZPQESA-N Copied
Cite this record
CSID:396248, http://www.chemspider.com/Chemical-Structure.396248.html (accessed 09:14, May 26, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

MOLI000188 [DBID]

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

Click to predict properties on the Chemicalize site

Patents	Personal Collections
Publication or Magazine Article	Web-based Article (blog or commentary)
Available Chemicals Databases	Biological Properties
Chemical Reactions	Chemical Safety Data
Drugs or Compounds in Development	Imaging Agents
Information Aggregators	Journal Publishers via MeSH
Ligand/binding/crystal Structure Databases	Metabolic Pathways
Molecular Libraries Screening Center Network	Natural Products
NIH Substance Repository	Physical Properties (including SAR/QSAR databases)
Protein 3D Structures	Spectroscopy Databases
Substance Vendors	Theoretical Properties
Toxicology/Environmental Databases	Virtual Library

Advertise Sponsor