CID 4778083

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

Structural Information

Molecular Formula
C8H5Cl2N3O
SMILES
C1=CC(=C(C=C1Cl)Cl)C2=NN=C(O2)N
InChI
InChI=1S/C8H5Cl2N3O/c9-4-1-2-5(6(10)3-4)7-12-13-8(11)14-7/h1-3H,(H2,11,13)
InChIKey
CFAKQLAZXZWZLX-UHFFFAOYSA-N
Compound name
5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

228.98097 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.98825 143.7
[M+Na]+ 251.97019 159.1
[M+NH4]+ 247.01479 152.2
[M+K]+ 267.94413 153.9
[M-H]- 227.97369 148.1
[M+Na-2H]- 249.95564 151.6
[M]+ 228.98042 147.7
[M]- 228.98152 147.7
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