CID 75356417

Potassium trifluoro(pentan-3-yl)boranuide

Structural Information

Molecular Formula
C5H11BF3
SMILES
[B-](C(CC)CC)(F)(F)F
InChI
InChI=1S/C5H11BF3/c1-3-5(4-2)6(7,8)9/h5H,3-4H2,1-2H3/q-1
InChIKey
QXLTUGHKNSEQPA-UHFFFAOYSA-N
Compound name
trifluoro(pentan-3-yl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.09059 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.097866 124.2
[M+Na]+ 162.079808 131.6
[M-H]- 138.083314 119.1
[M+NH4]+ 157.124413 145.5
[M+K]+ 178.053748 131.2
[M+H-H2O]+ 122.087850 120.4
[M+HCOO]- 184.088791 141.9
[M+CH3COO]- 198.104441 173.4
[M+Na-2H]- 160.065256 128.2
[M]+ 139.09004142 118.4
[M]- 139.09113858 118.4
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.