CID 112756589

Potassium trifluoro[3-(methoxycarbonyl)cyclobutyl]boranuide

Structural Information

Molecular Formula
C6H9BF3O2
SMILES
[B-](C1CC(C1)C(=O)OC)(F)(F)F
InChI
InChI=1S/C6H9BF3O2/c1-12-6(11)4-2-5(3-4)7(8,9)10/h4-5H,2-3H2,1H3/q-1
InChIKey
KCFDBLGJAXCBAP-UHFFFAOYSA-N
Compound name
trifluoro-(3-methoxycarbonylcyclobutyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.06477 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.07205 144.9
[M+Na]+ 204.05399 147.4
[M+NH4]+ 199.09859 145.9
[M+K]+ 220.02793 146.2
[M-H]- 180.05749 137.5
[M+Na-2H]- 202.03944 143.0
[M]+ 181.06422 141.3
[M]- 181.06532 141.3
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.