CID 114562

1,2-dibromo-1,1,2-trichloroethane

Structural Information

Molecular Formula
C2HBr2Cl3
SMILES
C(C(Cl)(Cl)Br)(Cl)Br
InChI
InChI=1S/C2HBr2Cl3/c3-1(5)2(4,6)7/h1H
InChIKey
VXKOVUFOVCJHBA-UHFFFAOYSA-N
Compound name
1,2-dibromo-1,1,2-trichloroethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

162
Patents

287.75107 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.75835 135.1
[M+Na]+ 310.74029 149.0
[M-H]- 286.74379 138.8
[M+NH4]+ 305.78489 155.7
[M+K]+ 326.71423 130.5
[M+H-H2O]+ 270.74833 145.5
[M+HCOO]- 332.74927 138.4
[M+CH3COO]- 346.76492 199.7
[M+Na-2H]- 308.72574 142.3
[M]+ 287.75052 167.9
[M]- 287.75162 167.9
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