CID 155819438

2490432-81-8

Structural Information

Molecular Formula
C6H10FN
SMILES
C1CNCC2(C1C2)F
InChI
InChI=1S/C6H10FN/c7-6-3-5(6)1-2-8-4-6/h5,8H,1-4H2
InChIKey
LCXUQXGXELCTMF-UHFFFAOYSA-N
Compound name
1-fluoro-3-azabicyclo[4.1.0]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

115.07973 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.087006 125.1
[M+Na]+ 138.068948 134.1
[M-H]- 114.072454 126.3
[M+NH4]+ 133.113553 143.6
[M+K]+ 154.042888 131.8
[M+H-H2O]+ 98.076990 118.8
[M+HCOO]- 160.077931 142.3
[M+CH3COO]- 174.093581 137.6
[M+Na-2H]- 136.054396 133.4
[M]+ 115.07918142 121.4
[M]- 115.08027858 121.4
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.