CID 61552926

1-(5-fluoropyridin-3-yl)-2-methoxyethan-1-amine

Structural Information

Molecular Formula
C8H11FN2O
SMILES
COCC(C1=CC(=CN=C1)F)N
InChI
InChI=1S/C8H11FN2O/c1-12-5-8(10)6-2-7(9)4-11-3-6/h2-4,8H,5,10H2,1H3
InChIKey
OQLHXKOKNRJVFG-UHFFFAOYSA-N
Compound name
1-(5-fluoropyridin-3-yl)-2-methoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.08554 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.09282 134.2
[M+Na]+ 193.07476 141.9
[M-H]- 169.07826 134.9
[M+NH4]+ 188.11936 152.9
[M+K]+ 209.04870 140.2
[M+H-H2O]+ 153.08280 126.6
[M+HCOO]- 215.08374 156.4
[M+CH3COO]- 229.09939 181.8
[M+Na-2H]- 191.06021 139.8
[M]+ 170.08499 132.6
[M]- 170.08609 132.6
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.