CID 59327129

2-fluoro-3-iodo-6-methoxypyridine

Structural Information

Molecular Formula
C6H5FINO
SMILES
COC1=NC(=C(C=C1)I)F
InChI
InChI=1S/C6H5FINO/c1-10-5-3-2-4(8)6(7)9-5/h2-3H,1H3
InChIKey
WGLUCEAKXSVMJI-UHFFFAOYSA-N
Compound name
2-fluoro-3-iodo-6-methoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

252.93999 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.94727 130.5
[M+Na]+ 275.92921 133.6
[M-H]- 251.93271 125.2
[M+NH4]+ 270.97381 146.1
[M+K]+ 291.90315 138.0
[M+H-H2O]+ 235.93725 120.2
[M+HCOO]- 297.93819 148.6
[M+CH3COO]- 311.95384 183.6
[M+Na-2H]- 273.91466 126.0
[M]+ 252.93944 128.4
[M]- 252.94054 128.4
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

patents stripe