CID 132343955

3-(2-fluoroethyl)-8-azabicyclo[3.2.1]octane

Structural Information

Molecular Formula
C9H16FN
SMILES
C1CC2CC(CC1N2)CCF
InChI
InChI=1S/C9H16FN/c10-4-3-7-5-8-1-2-9(6-7)11-8/h7-9,11H,1-6H2
InChIKey
LCOJMTGKRWZKLZ-UHFFFAOYSA-N
Compound name
3-(2-fluoroethyl)-8-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.12668 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.133956 135.3
[M+Na]+ 180.115898 140.8
[M-H]- 156.119404 133.2
[M+NH4]+ 175.160503 157.6
[M+K]+ 196.089838 137.7
[M+H-H2O]+ 140.123940 128.8
[M+HCOO]- 202.124881 150.5
[M+CH3COO]- 216.140531 175.3
[M+Na-2H]- 178.101346 139.1
[M]+ 157.12613142 128.7
[M]- 157.12722858 128.7
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.