CID 55283232

Potassium [(azetidin-1-yl)methyl]trifluoroboranuide

Structural Information

Molecular Formula
C4H8BF3N
SMILES
[B-](CN1CCC1)(F)(F)F
InChI
InChI=1S/C4H8BF3N/c6-5(7,8)4-9-2-1-3-9/h1-4H2/q-1
InChIKey
CIRHCQHVXTYAIJ-UHFFFAOYSA-N
Compound name
azetidin-1-ylmethyl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.07019 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.07747 120.6
[M+Na]+ 161.05941 127.0
[M-H]- 137.06291 117.3
[M+NH4]+ 156.10401 134.0
[M+K]+ 177.03335 129.1
[M+H-H2O]+ 121.06745 110.5
[M+HCOO]- 183.06839 136.8
[M+CH3COO]- 197.08404 173.7
[M+Na-2H]- 159.04486 126.2
[M]+ 138.06964 121.5
[M]- 138.07074 121.5
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.