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Substance Name: 4-tert-Butyl-1-(4-iodophenyl)-2,6,7-trioxabicyclo(2.2.2)octane
RN: 117439-67-5
InChIKey: XFHCOMPFTDWWQD-UHFFFAOYSA-N

Note

  • An imaging agent for the GABA(A) receptor.

Molecular Formula

  • C15-H19-I-O3

Molecular Weight

  • 374.212
 
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Names and Synonyms

Name of Substance

  • 4-tert-Butyl-1-(4-iodophenyl)-2,6,7-trioxabicyclo(2.2.2)octane

Synonym

  • 4-I-Tbob

Systematic Name

  • 2,6,7-Trioxabicyclo(2.2.2)octane, 4-(1,1-dimethylethyl)-1-(4-iodophenyl)-

Registry Numbers

CAS Registry Number

  • 117439-67-5

System Generated Number

  • 0117439675

Structure Descriptors

InChI

1S/C15H19IO3/c1-13(2,3)14-8-17-15(18-9-14,19-10-14)11-4-6-12(16)7-5-11/h4-7H,8-10H2,1-3H3

InChIKey

XFHCOMPFTDWWQD-UHFFFAOYSA-N

Smiles

C12(OCC(CO1)(CO2)C(C)(C)C)c1ccc(cc1)I