CID 133622765

En300-7546892

Structural Information

Molecular Formula
C11H20BF3NO2
SMILES
[B-](CC1CCCN(C1)C(=O)OC(C)(C)C)(F)(F)F
InChI
InChI=1S/C11H20BF3NO2/c1-11(2,3)18-10(17)16-6-4-5-9(8-16)7-12(13,14)15/h9H,4-8H2,1-3H3/q-1
InChIKey
ISFHIIGJDOPGRV-UHFFFAOYSA-N
Compound name
trifluoro-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-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 162.1
[M+Na]+ 289.14315 167.2
[M+NH4]+ 284.18775 165.4
[M+K]+ 305.11709 164.8
[M-H]- 265.14665 156.2
[M+Na-2H]- 287.12860 161.7
[M]+ 266.15338 160.4
[M]- 266.15448 160.4
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.