CID 68531

590-16-9

Structural Information

Molecular Formula
C2H4BrI
SMILES
C(CI)Br
InChI
InChI=1S/C2H4BrI/c3-1-2-4/h1-2H2
InChIKey
HKQCJJOXYWQRFN-UHFFFAOYSA-N
Compound name
1-bromo-2-iodoethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

266
Patents

233.85411 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.86139 125.0
[M+Na]+ 256.84333 130.3
[M-H]- 232.84683 122.2
[M+NH4]+ 251.88793 145.7
[M+K]+ 272.81727 127.0
[M+H-H2O]+ 216.85137 123.0
[M+HCOO]- 278.85231 142.6
[M+CH3COO]- 292.86796 178.7
[M+Na-2H]- 254.82878 123.2
[M]+ 233.85356 139.9
[M]- 233.85466 139.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe