CID 11542830

608140-67-6

Structural Information

Molecular Formula
C4H7BF3
SMILES
[B-](CCC=C)(F)(F)F
InChI
InChI=1S/C4H7BF3/c1-2-3-4-5(6,7)8/h2H,1,3-4H2/q-1
InChIKey
JJJLHRNOIJPOMY-UHFFFAOYSA-N
Compound name
but-3-enyl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

123.05929 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.066566 118.2
[M+Na]+ 146.048508 126.4
[M-H]- 122.052014 113.2
[M+NH4]+ 141.093113 140.1
[M+K]+ 162.022448 125.3
[M+H-H2O]+ 106.056550 114.6
[M+HCOO]- 168.057491 137.3
[M+CH3COO]- 182.073141 168.6
[M+Na-2H]- 144.033956 123.9
[M]+ 123.05874142 111.9
[M]- 123.05983858 111.9
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