CID 55268170

1430219-80-9

Structural Information

Molecular Formula
C5H9BF3O
SMILES
[B-](C1CCCOC1)(F)(F)F
InChI
InChI=1S/C5H9BF3O/c7-6(8,9)5-2-1-3-10-4-5/h5H,1-4H2/q-1
InChIKey
RBJUBZBJVNSFSV-UHFFFAOYSA-N
Compound name
trifluoro(oxan-3-yl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.06985 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.07713 124.5
[M+Na]+ 176.05907 130.2
[M-H]- 152.06257 122.5
[M+NH4]+ 171.10367 143.4
[M+K]+ 192.03301 130.5
[M+H-H2O]+ 136.06711 119.6
[M+HCOO]- 198.06805 139.8
[M+CH3COO]- 212.08370 170.5
[M+Na-2H]- 174.04452 130.5
[M]+ 153.06930 114.6
[M]- 153.07040 114.6
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.