CID 163320991

2195389-89-8

Structural Information

Molecular Formula
C10H16BF3NO2
SMILES
[B-](C12CC(C1)(C2)NC(=O)OC(C)(C)C)(F)(F)F
InChI
InChI=1S/C10H16BF3NO2/c1-8(2,3)17-7(16)15-10-4-9(5-10,6-10)11(12,13)14/h4-6H2,1-3H3,(H,15,16)/q-1
InChIKey
MKTDTUMYRMSRPO-UHFFFAOYSA-N
Compound name
trifluoro-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-bicyclo[1.1.1]pentanyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.12262 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.12990 178.9
[M+Na]+ 273.11184 172.9
[M+NH4]+ 268.15644 175.9
[M+K]+ 289.08578 171.7
[M-H]- 249.11534 167.9
[M+Na-2H]- 271.09729 171.9
[M]+ 250.12207 172.2
[M]- 250.12317 172.2
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.