CID 145867479

Potassium [3-(cyclopropylmethyl)cyclobutyl]trifluoroboranuide

Structural Information

Molecular Formula
C8H13BF3
SMILES
[B-](C1CC(C1)CC2CC2)(F)(F)F
InChI
InChI=1S/C8H13BF3/c10-9(11,12)8-4-7(5-8)3-6-1-2-6/h6-8H,1-5H2/q-1
InChIKey
IFONUGJCJIBNSB-UHFFFAOYSA-N
Compound name
[3-(cyclopropylmethyl)cyclobutyl]-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.10625 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.11353 125.3
[M+Na]+ 200.09547 132.6
[M-H]- 176.09897 127.3
[M+NH4]+ 195.14007 134.3
[M+K]+ 216.06941 132.9
[M+H-H2O]+ 160.10351 114.9
[M+HCOO]- 222.10445 142.1
[M+CH3COO]- 236.12010 185.8
[M+Na-2H]- 198.08092 129.3
[M]+ 177.10570 128.5
[M]- 177.10680 128.5
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.