CID 20116494

5-(2-bromo-4-fluorophenyl)-1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C8H5BrFN3O
SMILES
C1=CC(=C(C=C1F)Br)C2=NN=C(O2)N
InChI
InChI=1S/C8H5BrFN3O/c9-6-3-4(10)1-2-5(6)7-12-13-8(11)14-7/h1-3H,(H2,11,13)
InChIKey
VGZKXDFCISOURP-UHFFFAOYSA-N
Compound name
5-(2-bromo-4-fluorophenyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.96 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.96728 152.3
[M+Na]+ 279.94922 155.8
[M+NH4]+ 274.99382 156.0
[M+K]+ 295.92316 157.6
[M-H]- 255.95272 153.5
[M+Na-2H]- 277.93467 155.4
[M]+ 256.95945 151.9
[M]- 256.96055 151.9
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.