CID 23434398

519050-77-2

Structural Information

Molecular Formula
C9H9FO4
SMILES
COC1=C(C(=CC=C1)F)OCC(=O)O
InChI
InChI=1S/C9H9FO4/c1-13-7-4-2-3-6(10)9(7)14-5-8(11)12/h2-4H,5H2,1H3,(H,11,12)
InChIKey
KLZJSQDVSPJMAA-UHFFFAOYSA-N
Compound name
2-(2-fluoro-6-methoxyphenoxy)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

200.0485 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.05578 137.1
[M+Na]+ 223.03772 145.8
[M-H]- 199.04122 138.7
[M+NH4]+ 218.08232 155.9
[M+K]+ 239.01166 144.7
[M+H-H2O]+ 183.04576 130.7
[M+HCOO]- 245.04670 159.3
[M+CH3COO]- 259.06235 181.8
[M+Na-2H]- 221.02317 141.7
[M]+ 200.04795 139.3
[M]- 200.04905 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

patents stripe