CID 16128035

Potassium {[benzyl(methyl)amino]methyl}trifluoroboranuide

Structural Information

Molecular Formula
C9H12BF3N
SMILES
[B-](CN(C)CC1=CC=CC=C1)(F)(F)F
InChI
InChI=1S/C9H12BF3N/c1-14(8-10(11,12)13)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3/q-1
InChIKey
JRTRNQRZOUGDCI-UHFFFAOYSA-N
Compound name
[benzyl(methyl)amino]methyl-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.10149 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.10877 137.3
[M+Na]+ 225.09071 143.7
[M-H]- 201.09421 136.4
[M+NH4]+ 220.13531 156.0
[M+K]+ 241.06465 142.1
[M+H-H2O]+ 185.09875 131.0
[M+HCOO]- 247.09969 157.7
[M+CH3COO]- 261.11534 187.9
[M+Na-2H]- 223.07616 142.6
[M]+ 202.10094 131.6
[M]- 202.10204 131.6
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.