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]+ 137.06181 119.3
[M+Na]+ 159.04375 128.6
[M-H]- 135.04725 115.2
[M+NH4]+ 154.08835 138.4
[M+K]+ 175.01769 128.0
[M+H-H2O]+ 119.05179 108.8
[M+HCOO]- 181.05273 135.4
[M+CH3COO]- 195.06838 184.0
[M+Na-2H]- 157.02920 125.0
[M]+ 136.05398 109.4
[M]- 136.05508 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.