CID 131413262

Potassium 3-cyanopropyltrifluoroborate

Structural Information

Molecular Formula
C4H6BF3N
SMILES
[B-](CCCC#N)(F)(F)F
InChI
InChI=1S/C4H6BF3N/c6-5(7,8)3-1-2-4-9/h1-3H2/q-1
InChIKey
CZIWAANGFIQSAK-UHFFFAOYSA-N
Compound name
3-cyanopropyl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

136.05453 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.061806 119.3
[M+Na]+ 159.043748 128.6
[M-H]- 135.047254 115.2
[M+NH4]+ 154.088353 138.4
[M+K]+ 175.017688 128.0
[M+H-H2O]+ 119.051790 108.8
[M+HCOO]- 181.052731 135.4
[M+CH3COO]- 195.068381 184.0
[M+Na-2H]- 157.029196 125.0
[M]+ 136.05398142 109.4
[M]- 136.05507858 109.4
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.