CID 5051771

2-[(carbamoylmethyl)amino]acetamide

Structural Information

Molecular Formula
C4H9N3O2
SMILES
C(C(=O)N)NCC(=O)N
InChI
InChI=1S/C4H9N3O2/c5-3(8)1-7-2-4(6)9/h7H,1-2H2,(H2,5,8)(H2,6,9)
InChIKey
HGMBEFYZNDKFQJ-UHFFFAOYSA-N
Compound name
2-[(2-amino-2-oxoethyl)amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

76
Patents

131.06947 Da
Monoisotopic Mass

-2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.07675 125.9
[M+Na]+ 154.05869 131.3
[M-H]- 130.06219 125.3
[M+NH4]+ 149.10329 146.0
[M+K]+ 170.03263 131.5
[M+H-H2O]+ 114.06673 120.0
[M+HCOO]- 176.06767 150.8
[M+CH3COO]- 190.08332 178.7
[M+Na-2H]- 152.04414 129.8
[M]+ 131.06892 121.9
[M]- 131.07002 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

literature stripe

Patent stripe

patents stripe