CID 65416185

4-(3-amino-1,2,4-oxadiazol-5-yl)pyridin-2-amine

Structural Information

Molecular Formula
C7H7N5O
SMILES
C1=CN=C(C=C1C2=NC(=NO2)N)N
InChI
InChI=1S/C7H7N5O/c8-5-3-4(1-2-10-5)6-11-7(9)12-13-6/h1-3H,(H2,8,10)(H2,9,12)
InChIKey
NIPFGPYXWPGGES-UHFFFAOYSA-N
Compound name
5-(2-aminopyridin-4-yl)-1,2,4-oxadiazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.06506 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.07234 134.7
[M+Na]+ 200.05428 144.7
[M-H]- 176.05778 138.4
[M+NH4]+ 195.09888 150.3
[M+K]+ 216.02822 142.5
[M+H-H2O]+ 160.06232 125.9
[M+HCOO]- 222.06326 158.4
[M+CH3COO]- 236.07891 148.1
[M+Na-2H]- 198.03973 142.0
[M]+ 177.06451 133.2
[M]- 177.06561 133.2
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.