CID 2782853

Potassium 4-methoxyphenyltrifluoroborate

Structural Information

Molecular Formula
C7H7BF3O
SMILES
[B-](C1=CC=C(C=C1)OC)(F)(F)F
InChI
InChI=1S/C7H7BF3O/c1-12-7-4-2-6(3-5-7)8(9,10)11/h2-5H,1H3/q-1
InChIKey
PKHKLXHYDFYEAO-UHFFFAOYSA-N
Compound name
trifluoro-(4-methoxyphenyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

41
Patents

175.0542 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.06148 127.0
[M+Na]+ 198.04342 135.9
[M-H]- 174.04692 125.5
[M+NH4]+ 193.08802 146.8
[M+K]+ 214.01736 134.0
[M+H-H2O]+ 158.05146 121.9
[M+HCOO]- 220.05240 146.8
[M+CH3COO]- 234.06805 176.7
[M+Na-2H]- 196.02887 133.2
[M]+ 175.05365 121.9
[M]- 175.05475 121.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe