CID 2774559

5-fluoro-2-methoxyphenol

Structural Information

Molecular Formula
C7H7FO2
SMILES
COC1=C(C=C(C=C1)F)O
InChI
InChI=1S/C7H7FO2/c1-10-7-3-2-5(8)4-6(7)9/h2-4,9H,1H3
InChIKey
PPJKLEQAFZWIQY-UHFFFAOYSA-N
Compound name
5-fluoro-2-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

264
Patents

142.04301 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.05029 122.9
[M+Na]+ 165.03223 132.7
[M-H]- 141.03573 124.8
[M+NH4]+ 160.07683 144.4
[M+K]+ 181.00617 131.0
[M+H-H2O]+ 125.04027 117.3
[M+HCOO]- 187.04121 146.1
[M+CH3COO]- 201.05686 171.6
[M+Na-2H]- 163.01768 129.9
[M]+ 142.04246 122.8
[M]- 142.04356 122.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe