CID 146082456

2415072-76-1

Structural Information

Molecular Formula
C4H7BF3O
SMILES
[B-](CC1COC1)(F)(F)F
InChI
InChI=1S/C4H7BF3O/c6-5(7,8)1-4-2-9-3-4/h4H,1-3H2/q-1
InChIKey
GTXTVGBISONGJN-UHFFFAOYSA-N
Compound name
trifluoro(oxetan-3-ylmethyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.0542 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.06148 116.7
[M+Na]+ 162.04342 123.0
[M-H]- 138.04692 115.5
[M+NH4]+ 157.08802 130.1
[M+K]+ 178.01736 126.6
[M+H-H2O]+ 122.05146 107.6
[M+HCOO]- 184.05240 133.5
[M+CH3COO]- 198.06805 173.0
[M+Na-2H]- 160.02887 123.6
[M]+ 139.05365 119.1
[M]- 139.05475 119.1
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.