CID 170916455

Potassium (2-((tert-butoxy)carbonyl)-2-azaspiro(3.3)heptan-6-yl)trifluoroboranuide

Structural Information

Molecular Formula
C11H18BF3NO2
SMILES
[B-](C1CC2(C1)CN(C2)C(=O)OC(C)(C)C)(F)(F)F
InChI
InChI=1S/C11H18BF3NO2/c1-10(2,3)18-9(17)16-6-11(7-16)4-8(5-11)12(13,14)15/h8H,4-7H2,1-3H3/q-1
InChIKey
UGEMJFVJVAJEQB-UHFFFAOYSA-N
Compound name
trifluoro-[2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azaspiro[3.3]heptan-6-yl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.13828 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.14556 154.2
[M+Na]+ 287.12750 158.3
[M-H]- 263.13100 153.3
[M+NH4]+ 282.17210 158.6
[M+K]+ 303.10144 162.3
[M+H-H2O]+ 247.13554 140.9
[M+HCOO]- 309.13648 163.9
[M+CH3COO]- 323.15213 203.4
[M+Na-2H]- 285.11295 156.4
[M]+ 264.13773 164.6
[M]- 264.13883 164.6
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.