CID 91758993

1262538-15-7

Structural Information

Molecular Formula
C3H6BBrF3
SMILES
[B-](CCCBr)(F)(F)F
InChI
InChI=1S/C3H6BBrF3/c5-3-1-2-4(6,7)8/h1-3H2/q-1
InChIKey
KWXBHRMWMPOBPW-UHFFFAOYSA-N
Compound name
3-bromopropyl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.9698 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.97708 132.4
[M+Na]+ 211.95902 144.2
[M-H]- 187.96252 130.6
[M+NH4]+ 207.00362 155.1
[M+K]+ 227.93296 134.0
[M+H-H2O]+ 171.96706 133.8
[M+HCOO]- 233.96800 149.4
[M+CH3COO]- 247.98365 177.6
[M+Na-2H]- 209.94447 139.1
[M]+ 188.96925 145.3
[M]- 188.97035 145.3
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

No patent data available for this compound.