CID 137935572

Potassium [2-(difluoromethyl)-1,3-thiazol-4-yl]trifluoroboranuide

Structural Information

Molecular Formula
C4H2BF5NS
SMILES
[B-](C1=CSC(=N1)C(F)F)(F)(F)F
InChI
InChI=1S/C4H2BF5NS/c6-3(7)4-11-2(1-12-4)5(8,9)10/h1,3H/q-1
InChIKey
DSXLABZAPJCHKQ-UHFFFAOYSA-N
Compound name
[2-(difluoromethyl)-1,3-thiazol-4-yl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.99211 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.99939 126.5
[M+Na]+ 224.98133 136.5
[M-H]- 200.98483 121.5
[M+NH4]+ 220.02593 146.0
[M+K]+ 240.95527 133.9
[M+H-H2O]+ 184.98937 119.3
[M+HCOO]- 246.99031 138.2
[M+CH3COO]- 261.00596 178.9
[M+Na-2H]- 222.96678 126.5
[M]+ 201.99156 119.2
[M]- 201.99266 119.2
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.