CID 61169

Dibromoacetylene

Structural Information

Molecular Formula
C2Br2
SMILES
C(#CBr)Br
InChI
InChI=1S/C2Br2/c3-1-2-4
InChIKey
JNFBOWNNNAHVNZ-UHFFFAOYSA-N
Compound name
1,2-dibromoethyne
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

232
Patents

181.83669 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.84397 103.6
[M+Na]+ 204.82591 117.7
[M-H]- 180.82941 105.7
[M+NH4]+ 199.87051 124.2
[M+K]+ 220.79985 102.9
[M+H-H2O]+ 164.83395 107.3
[M+HCOO]- 226.83489 120.6
[M+CH3COO]- 240.85054 194.2
[M+Na-2H]- 202.81136 113.7
[M]+ 181.83614 129.5
[M]- 181.83724 129.5
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