CID 130062975

Methyl 6-fluoro-1-benzofuran-4-carboxylate

Structural Information

Molecular Formula
C10H7FO3
SMILES
COC(=O)C1=C2C=COC2=CC(=C1)F
InChI
InChI=1S/C10H7FO3/c1-13-10(12)8-4-6(11)5-9-7(8)2-3-14-9/h2-5H,1H3
InChIKey
OWDKZDRBBPJKCD-UHFFFAOYSA-N
Compound name
methyl 6-fluoro-1-benzofuran-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.03792 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.04520 137.1
[M+Na]+ 217.02714 150.1
[M+NH4]+ 212.07174 145.2
[M+K]+ 233.00108 146.4
[M-H]- 193.03064 138.7
[M+Na-2H]- 215.01259 142.4
[M]+ 194.03737 139.3
[M]- 194.03847 139.3
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.