CID 21508

2,3-dibromobutane

Structural Information

Molecular Formula
C4H8Br2
SMILES
CC(C(C)Br)Br
InChI
InChI=1S/C4H8Br2/c1-3(5)4(2)6/h3-4H,1-2H3
InChIKey
BXXWFOGWXLJPPA-UHFFFAOYSA-N
Compound name
2,3-dibromobutane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4723
Patents

213.89928 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.90656 132.7
[M+Na]+ 236.88850 127.0
[M+NH4]+ 231.93310 135.1
[M+K]+ 252.86244 134.1
[M-H]- 212.89200 132.4
[M+Na-2H]- 234.87395 133.5
[M]+ 213.89873 130.6
[M]- 213.89983 130.6
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