CID 2758985

288401-62-7

Structural Information

Molecular Formula
C9H6FNO2
SMILES
C1=CC(=C(C=C1F)C2=CC=NO2)O
InChI
InChI=1S/C9H6FNO2/c10-6-1-2-8(12)7(5-6)9-3-4-11-13-9/h1-5,12H
InChIKey
GMKVPJVBXXTBJG-UHFFFAOYSA-N
Compound name
4-fluoro-2-(1,2-oxazol-5-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

179.03825 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.04553 135.1
[M+Na]+ 202.02747 148.5
[M+NH4]+ 197.07207 143.0
[M+K]+ 218.00141 144.5
[M-H]- 178.03097 137.9
[M+Na-2H]- 200.01292 142.4
[M]+ 179.03770 137.7
[M]- 179.03880 137.7
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