CID 16218201

1290639-49-4

Structural Information

Molecular Formula
C6H13BF3
SMILES
[B-](CCC(C)(C)C)(F)(F)F
InChI
InChI=1S/C6H13BF3/c1-6(2,3)4-5-7(8,9)10/h4-5H2,1-3H3/q-1
InChIKey
VCACVZVTLITDRA-UHFFFAOYSA-N
Compound name
3,3-dimethylbutyl(trifluoro)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

153.10625 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.113526 128.9
[M+Na]+ 176.095468 136.7
[M-H]- 152.098974 124.0
[M+NH4]+ 171.140073 149.9
[M+K]+ 192.069408 136.0
[M+H-H2O]+ 136.103510 125.5
[M+HCOO]- 198.104451 145.7
[M+CH3COO]- 212.120101 175.4
[M+Na-2H]- 174.080916 134.4
[M]+ 153.10570142 123.5
[M]- 153.10679858 123.5
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