CID 45588182

Potassium (tert-butoxymethyl)trifluoroborate

Structural Information

Molecular Formula
C5H11BF3O
SMILES
[B-](COC(C)(C)C)(F)(F)F
InChI
InChI=1S/C5H11BF3O/c1-5(2,3)10-4-6(7,8)9/h4H2,1-3H3/q-1
InChIKey
KCIIGUVUAQHRKK-UHFFFAOYSA-N
Compound name
trifluoro-[(2-methylpropan-2-yl)oxymethyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

155.08551 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.092786 127.7
[M+Na]+ 178.074728 135.8
[M-H]- 154.078234 122.9
[M+NH4]+ 173.119333 148.5
[M+K]+ 194.048668 135.7
[M+H-H2O]+ 138.082770 124.2
[M+HCOO]- 200.083711 145.0
[M+CH3COO]- 214.099361 174.2
[M+Na-2H]- 176.060176 133.8
[M]+ 155.08496142 123.2
[M]- 155.08605858 123.2
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

patents stripe