CID 106326

Bis(2,4,6-tribromophenyl) carbonate

Structural Information

Molecular Formula
C13H4Br6O3
SMILES
C1=C(C=C(C(=C1Br)OC(=O)OC2=C(C=C(C=C2Br)Br)Br)Br)Br
InChI
InChI=1S/C13H4Br6O3/c14-5-1-7(16)11(8(17)2-5)21-13(20)22-12-9(18)3-6(15)4-10(12)19/h1-4H
InChIKey
KYCZCJACRVPWFK-UHFFFAOYSA-N
Compound name
bis(2,4,6-tribromophenyl) carbonate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

24
Patents

681.52606 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 682.53334 168.9
[M+Na]+ 704.51528 168.2
[M+NH4]+ 699.55988 169.2
[M+K]+ 720.48922 169.2
[M-H]- 680.51878 169.4
[M+Na-2H]- 702.50073 169.2
[M]+ 681.52551 169.1
[M]- 681.52661 169.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe