CID 63701728

Trifluoro(propyl)boranuide

Structural Information

Molecular Formula
C3H7BF3
SMILES
[B-](CCC)(F)(F)F
InChI
InChI=1S/C3H7BF3/c1-2-3-4(5,6)7/h2-3H2,1H3/q-1
InChIKey
UHUCOXBNSICWFZ-UHFFFAOYSA-N
Compound name
trifluoro(propyl)boranuide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

26
Patents

111.05929 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.066566 114.9
[M+Na]+ 134.048508 123.3
[M-H]- 110.052014 110.0
[M+NH4]+ 129.093113 137.3
[M+K]+ 150.022448 123.0
[M+H-H2O]+ 94.056550 111.4
[M+HCOO]- 156.057491 134.2
[M+CH3COO]- 170.073141 166.5
[M+Na-2H]- 132.033956 121.2
[M]+ 111.05874142 109.0
[M]- 111.05983858 109.0
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

patents stripe