CAS Number

488710-24-3

Alternate CAS Number

-

Unlabelled CAS Number

207122-16-5

Molecular Formula

13C12 H3 Br7 O

Molecular Weight

734.39

Accurate Mass

727.487

SMILES

Br[13c]1[13cH][13c](Br)[13c](O[13c]2[13c](Br)[13cH][13c](Br)[13c](Br)[13c]2Br)[13cH][13c]1Br

InChI

InChI=1S/C12H3Br7O/c13-4-1-6(15)9(3-5(4)14)20-12-8(17)2-7(16)10(18)11(12)19/h1-3H/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1

IUPAC

1,2,3,5-tetrabromo-4-(3,4,6-tribromo(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-trien-1-yl)oxy(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-triene

CAS Number

678997-41-6

Alternate CAS Number

-

Unlabelled CAS Number

189084-64-8

Molecular Formula

13C12 H5 Br5 O

Molecular Weight

576.60

Accurate Mass

571.666

SMILES

Br[13c]1[13cH][13cH][13c](O[13c]2[13c](Br)[13cH][13c](Br)[13cH][13c]2Br)[13c](Br)[13cH]1

InChI

InChI=1S/C12H5Br5O/c13-6-1-2-11(8(15)3-6)18-12-9(16)4-7(14)5-10(12)17/h1-5H/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1

IUPAC

1,3,5-tribromo-2-(4,6-dibromo(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-trien-1-yl)oxy(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-triene