CID 129915567

1256788-43-8

Structural Information

Molecular Formula
C7H6FNO3
SMILES
COC(=O)C1=NC(=C(C=C1)O)F
InChI
InChI=1S/C7H6FNO3/c1-12-7(11)4-2-3-5(10)6(8)9-4/h2-3,10H,1H3
InChIKey
YOOCDAFKXIZPIV-UHFFFAOYSA-N
Compound name
methyl 6-fluoro-5-hydroxypyridine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.03317 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.04045 129.7
[M+Na]+ 194.02239 139.5
[M-H]- 170.02589 130.2
[M+NH4]+ 189.06699 148.5
[M+K]+ 209.99633 138.1
[M+H-H2O]+ 154.03043 123.0
[M+HCOO]- 216.03137 151.0
[M+CH3COO]- 230.04702 175.7
[M+Na-2H]- 192.00784 135.4
[M]+ 171.03262 130.1
[M]- 171.03372 130.1
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.