CID 45079809

2-fluoro-3-methoxypyridine

Structural Information

Molecular Formula
C6H6FNO
SMILES
COC1=C(N=CC=C1)F
InChI
InChI=1S/C6H6FNO/c1-9-5-3-2-4-8-6(5)7/h2-4H,1H3
InChIKey
YXYUTIBARPJYBX-UHFFFAOYSA-N
Compound name
2-fluoro-3-methoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

127.04334 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.05062 119.5
[M+Na]+ 150.03256 129.2
[M-H]- 126.03606 121.0
[M+NH4]+ 145.07716 140.6
[M+K]+ 166.00650 128.1
[M+H-H2O]+ 110.04060 112.7
[M+HCOO]- 172.04154 143.0
[M+CH3COO]- 186.05719 170.8
[M+Na-2H]- 148.01801 128.3
[M]+ 127.04279 119.6
[M]- 127.04389 119.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe