CID 46902165

Potassium trifluoro({[(4-methoxyphenyl)methoxy]methyl})boranuide

Structural Information

Molecular Formula
C9H11BF3O2
SMILES
[B-](COCC1=CC=C(C=C1)OC)(F)(F)F
InChI
InChI=1S/C9H11BF3O2/c1-14-9-4-2-8(3-5-9)6-15-7-10(11,12)13/h2-5H,6-7H2,1H3/q-1
InChIKey
OUXWPRVDRCMHOF-UHFFFAOYSA-N
Compound name
trifluoro-[(4-methoxyphenyl)methoxymethyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

219.08041 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.08769 140.2
[M+Na]+ 242.06963 148.1
[M-H]- 218.07313 138.2
[M+NH4]+ 237.11423 158.1
[M+K]+ 258.04357 146.2
[M+H-H2O]+ 202.07767 134.3
[M+HCOO]- 264.07861 159.5
[M+CH3COO]- 278.09426 184.7
[M+Na-2H]- 240.05508 145.3
[M]+ 219.07986 137.2
[M]- 219.08096 137.2
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.