CID 20119160

5-(2-chloro-6-fluorophenyl)-1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C8H5ClFN3O
SMILES
C1=CC(=C(C(=C1)Cl)C2=NN=C(O2)N)F
InChI
InChI=1S/C8H5ClFN3O/c9-4-2-1-3-5(10)6(4)7-12-13-8(11)14-7/h1-3H,(H2,11,13)
InChIKey
OWAYIIRZEKFZKG-UHFFFAOYSA-N
Compound name
5-(2-chloro-6-fluorophenyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.01051 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.01779 139.7
[M+Na]+ 235.99973 153.5
[M+NH4]+ 231.04433 147.3
[M+K]+ 251.97367 149.3
[M-H]- 212.00323 142.7
[M+Na-2H]- 233.98518 146.9
[M]+ 213.00996 142.6
[M]- 213.01106 142.6
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.