CID 75468758

5-(2-aminoethyl)-1,3,4-oxadiazol-2-amine dihydrochloride

Structural Information

Molecular Formula
C4H8N4O
SMILES
C(CN)C1=NN=C(O1)N
InChI
InChI=1S/C4H8N4O/c5-2-1-3-7-8-4(6)9-3/h1-2,5H2,(H2,6,8)
InChIKey
KDONHLLXEDAHMK-UHFFFAOYSA-N
Compound name
5-(2-aminoethyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

128.06981 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.077086 123.3
[M+Na]+ 151.059028 131.9
[M-H]- 127.062534 124.4
[M+NH4]+ 146.103633 142.2
[M+K]+ 167.032968 131.7
[M+H-H2O]+ 111.067070 116.0
[M+HCOO]- 173.068011 147.6
[M+CH3COO]- 187.083661 173.2
[M+Na-2H]- 149.044476 130.4
[M]+ 128.06926142 121.9
[M]- 128.07035858 121.9
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