CID 20117779

5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C8H5F2N3O
SMILES
C1=CC(=C(C=C1F)F)C2=NN=C(O2)N
InChI
InChI=1S/C8H5F2N3O/c9-4-1-2-5(6(10)3-4)7-12-13-8(11)14-7/h1-3H,(H2,11,13)
InChIKey
CMSLVSMYYJLWGO-UHFFFAOYSA-N
Compound name
5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

197.04007 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.04735 139.3
[M+Na]+ 220.02929 151.1
[M+NH4]+ 215.07389 145.7
[M+K]+ 236.00323 147.8
[M-H]- 196.03279 140.6
[M+Na-2H]- 218.01474 145.4
[M]+ 197.03952 141.1
[M]- 197.04062 141.1
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