CID 71311048

Potassium 2-chlorothiophene-5-trifluoroborate

Structural Information

Molecular Formula
C4H2BClF3S
SMILES
[B-](C1=CC=C(S1)Cl)(F)(F)F
InChI
InChI=1S/C4H2BClF3S/c6-4-2-1-3(10-4)5(7,8)9/h1-2H/q-1
InChIKey
WSUZLMHJHNUNQV-UHFFFAOYSA-N
Compound name
(5-chlorothiophen-2-yl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.96109 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.96837 125.9
[M+Na]+ 207.95031 136.7
[M-H]- 183.95381 124.8
[M+NH4]+ 202.99491 148.5
[M+K]+ 223.92425 132.7
[M+H-H2O]+ 167.95835 122.3
[M+HCOO]- 229.95929 137.3
[M+CH3COO]- 243.97494 173.6
[M+Na-2H]- 205.93576 127.4
[M]+ 184.96054 123.0
[M]- 184.96164 123.0
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

No patent data available for this compound.