CID 239787

1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C2H3N3O
SMILES
C1=NN=C(O1)N
InChI
InChI=1S/C2H3N3O/c3-2-5-4-1-6-2/h1H,(H2,3,5)
InChIKey
APKZPKINPXTSNL-UHFFFAOYSA-N
Compound name
1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

632
Patents

85.02761 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 86.034886 110.5
[M+Na]+ 108.01683 121.7
[M+NH4]+ 103.06143 118.5
[M+K]+ 123.99077 119.6
[M-H]- 84.020334 112.3
[M+Na-2H]- 106.00228 116.6
[M]+ 85.027061 112.3
[M]- 85.028159 112.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe