CID 165806544

2803127-27-5

Structural Information

Molecular Formula
C6H10BF3N
SMILES
[B-](C(C)(C)CCC#N)(F)(F)F
InChI
InChI=1S/C6H10BF3N/c1-6(2,4-3-5-11)7(8,9)10/h3-4H2,1-2H3/q-1
InChIKey
YVDZXNUINIRRHM-UHFFFAOYSA-N
Compound name
(4-cyano-2-methylbutan-2-yl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.08585 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.093126 130.7
[M+Na]+ 187.075068 139.5
[M-H]- 163.078574 126.6
[M+NH4]+ 182.119673 148.9
[M+K]+ 203.049008 139.0
[M+H-H2O]+ 147.083110 120.4
[M+HCOO]- 209.084051 144.8
[M+CH3COO]- 223.099701 189.8
[M+Na-2H]- 185.060516 135.8
[M]+ 164.08530142 120.8
[M]- 164.08639858 120.8
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.