CID 3506624

Potassium benzyltrifluoroboranuide

Structural Information

Molecular Formula
C7H7BF3
SMILES
[B-](CC1=CC=CC=C1)(F)(F)F
InChI
InChI=1S/C7H7BF3/c9-8(10,11)6-7-4-2-1-3-5-7/h1-5H,6H2/q-1
InChIKey
XPWOXPAWEYKWCG-UHFFFAOYSA-N
Compound name
benzyl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

168
Patents

159.0593 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.06658 123.8
[M+Na]+ 182.04852 131.9
[M-H]- 158.05202 121.9
[M+NH4]+ 177.09312 144.0
[M+K]+ 198.02246 129.5
[M+H-H2O]+ 142.05656 118.7
[M+HCOO]- 204.05750 143.5
[M+CH3COO]- 218.07315 173.7
[M+Na-2H]- 180.03397 130.7
[M]+ 159.05875 117.0
[M]- 159.05985 117.0
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