CID 136197513

1442432-29-2

Structural Information

Molecular Formula
C4H7N3O2
SMILES
C(CN)C1=NOC(=O)N1
InChI
InChI=1S/C4H7N3O2/c5-2-1-3-6-4(8)9-7-3/h1-2,5H2,(H,6,7,8)
InChIKey
GVGBBIDMUFFWQH-UHFFFAOYSA-N
Compound name
3-(2-aminoethyl)-4H-1,2,4-oxadiazol-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

129.05383 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.06111 122.9
[M+Na]+ 152.04305 133.0
[M+NH4]+ 147.08765 129.2
[M+K]+ 168.01699 131.3
[M-H]- 128.04655 123.3
[M+Na-2H]- 150.02850 126.8
[M]+ 129.05328 123.9
[M]- 129.05438 123.9
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