CID 140759504

1350729-28-0

Structural Information

Molecular Formula
C4H7BF3
SMILES
[B-]([C@@H]1C[C@H]1C)(F)(F)F
InChI
InChI=1S/C4H7BF3/c1-3-2-4(3)5(6,7)8/h3-4H,2H2,1H3/q-1/t3-,4-/m1/s1
InChIKey
YTYFTDRARRFOIU-QWWZWVQMSA-N
Compound name
trifluoro-[(1R,2R)-2-methylcyclopropyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

123.05929 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.06657 113.4
[M+Na]+ 146.04851 123.8
[M-H]- 122.05201 113.3
[M+NH4]+ 141.09311 130.7
[M+K]+ 162.02245 122.1
[M+H-H2O]+ 106.05655 108.4
[M+HCOO]- 168.05749 132.8
[M+CH3COO]- 182.07314 172.8
[M+Na-2H]- 144.03396 119.4
[M]+ 123.05874 109.6
[M]- 123.05984 109.6
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.