CID 2060332

3-(4-fluorophenyl)-1,2-oxazol-5-amine

Structural Information

Molecular Formula
C9H7FN2O
SMILES
C1=CC(=CC=C1C2=NOC(=C2)N)F
InChI
InChI=1S/C9H7FN2O/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,11H2
InChIKey
UUIDVOMRKXGYHN-UHFFFAOYSA-N
Compound name
3-(4-fluorophenyl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

178.05424 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.06152 132.8
[M+Na]+ 201.04346 142.8
[M-H]- 177.04696 138.0
[M+NH4]+ 196.08806 151.7
[M+K]+ 217.01740 140.6
[M+H-H2O]+ 161.05150 125.1
[M+HCOO]- 223.05244 157.1
[M+CH3COO]- 237.06809 147.1
[M+Na-2H]- 199.02891 139.2
[M]+ 178.05369 131.5
[M]- 178.05479 131.5
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