CID 75176015

Potassium trifluoro[4-(4-methoxyphenyl)phenyl]boranuide

Structural Information

Molecular Formula
C13H11BF3O
SMILES
[B-](C1=CC=C(C=C1)C2=CC=C(C=C2)OC)(F)(F)F
InChI
InChI=1S/C13H11BF3O/c1-18-13-8-4-11(5-9-13)10-2-6-12(7-3-10)14(15,16)17/h2-9H,1H3/q-1
InChIKey
QRCNQRJJPWAQJP-UHFFFAOYSA-N
Compound name
trifluoro-[4-(4-methoxyphenyl)phenyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.08551 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.09279 147.2
[M+Na]+ 274.07473 155.7
[M-H]- 250.07823 148.6
[M+NH4]+ 269.11933 163.8
[M+K]+ 290.04867 151.5
[M+H-H2O]+ 234.08277 140.1
[M+HCOO]- 296.08371 166.5
[M+CH3COO]- 310.09936 191.5
[M+Na-2H]- 272.06018 152.1
[M]+ 251.08496 142.1
[M]- 251.08606 142.1
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.