CID 44754778

3-fluoro-2-methoxypyridine

Structural Information

Molecular Formula
C6H6FNO
SMILES
COC1=C(C=CC=N1)F
InChI
InChI=1S/C6H6FNO/c1-9-6-5(7)3-2-4-8-6/h2-4H,1H3
InChIKey
VOXFISDIRIAWCW-UHFFFAOYSA-N
Compound name
3-fluoro-2-methoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

268
Patents

127.04334 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.050616 119.5
[M+Na]+ 150.032558 129.2
[M-H]- 126.036064 121.0
[M+NH4]+ 145.077163 140.6
[M+K]+ 166.006498 128.1
[M+H-H2O]+ 110.040600 112.7
[M+HCOO]- 172.041541 143.0
[M+CH3COO]- 186.057191 170.8
[M+Na-2H]- 148.018006 128.3
[M]+ 127.04279142 119.6
[M]- 127.04388858 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

No literature data available for this compound.

Patent stripe

patents stripe