CID 64981557

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

Structural Information

Molecular Formula
C9H7FN2O
SMILES
C1=CC=C(C(=C1)C2=CON=C2N)F
InChI
InChI=1S/C9H7FN2O/c10-8-4-2-1-3-6(8)7-5-13-12-9(7)11/h1-5H,(H2,11,12)
InChIKey
ZZMGAYMOPIGEFM-UHFFFAOYSA-N
Compound name
4-(2-fluorophenyl)-1,2-oxazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.05424 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.061516 132.8
[M+Na]+ 201.043458 142.8
[M-H]- 177.046964 138.0
[M+NH4]+ 196.088063 151.7
[M+K]+ 217.017398 140.6
[M+H-H2O]+ 161.051500 125.1
[M+HCOO]- 223.052441 157.1
[M+CH3COO]- 237.068091 147.1
[M+Na-2H]- 199.028906 139.2
[M]+ 178.05369142 131.5
[M]- 178.05478858 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

No patent data available for this compound.