CID 155821854

Potassium ({1-[(tert-butoxy)carbonyl]piperidin-4-yl}methyl)trifluoroboranuide

Structural Information

Molecular Formula
C11H20BF3NO2
SMILES
[B-](CC1CCN(CC1)C(=O)OC(C)(C)C)(F)(F)F
InChI
InChI=1S/C11H20BF3NO2/c1-11(2,3)18-10(17)16-6-4-9(5-7-16)8-12(13,14)15/h9H,4-8H2,1-3H3/q-1
InChIKey
RHCZHSLRKSRVEQ-UHFFFAOYSA-N
Compound name
trifluoro-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.15393 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.16121 158.4
[M+Na]+ 289.14315 163.2
[M-H]- 265.14665 154.2
[M+NH4]+ 284.18775 173.2
[M+K]+ 305.11709 161.7
[M+H-H2O]+ 249.15119 152.4
[M+HCOO]- 311.15213 169.2
[M+CH3COO]- 325.16778 192.7
[M+Na-2H]- 287.12860 159.7
[M]+ 266.15338 150.2
[M]- 266.15448 150.2
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

No patent data available for this compound.