CID 45790450

Potassium (2-cyanophenyl)trifluoroborate

Structural Information

Molecular Formula
C7H4BF3N
SMILES
[B-](C1=CC=CC=C1C#N)(F)(F)F
InChI
InChI=1S/C7H4BF3N/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-4H/q-1
InChIKey
RZJSQRJFABOHTG-UHFFFAOYSA-N
Compound name
(2-cyanophenyl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

170.0389 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.04618 136.2
[M+Na]+ 193.02812 146.4
[M+NH4]+ 188.07272 139.2
[M+K]+ 209.00206 138.0
[M-H]- 169.03162 126.6
[M+Na-2H]- 191.01357 138.5
[M]+ 170.03835 133.8
[M]- 170.03945 133.8
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

patents stripe