CID 15024261

736994-14-2

Structural Information

Molecular Formula
C4H9N3O
SMILES
C1C(CN1)(C(=O)N)N
InChI
InChI=1S/C4H9N3O/c5-3(8)4(6)1-7-2-4/h7H,1-2,6H2,(H2,5,8)
InChIKey
WRVSHWUIDTUUCQ-UHFFFAOYSA-N
Compound name
3-aminoazetidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

115.07456 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.08184 127.4
[M+Na]+ 138.06378 130.4
[M+NH4]+ 133.10838 131.6
[M+K]+ 154.03772 127.4
[M-H]- 114.06728 124.6
[M+Na-2H]- 136.04923 129.4
[M]+ 115.07401 125.5
[M]- 115.07511 125.5
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