CID 67308

138-07-8

Structural Information

Molecular Formula
C3H7N3O3
SMILES
C(C(=O)O)N(C(=O)N)N
InChI
InChI=1S/C3H7N3O3/c4-3(9)6(5)1-2(7)8/h1,5H2,(H2,4,9)(H,7,8)
InChIKey
WHNSJMMQNFSFBX-UHFFFAOYSA-N
Compound name
2-[amino(carbamoyl)amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

133.04874 Da
Monoisotopic Mass

-4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.05602 124.7
[M+Na]+ 156.03796 130.4
[M-H]- 132.04146 124.5
[M+NH4]+ 151.08256 144.7
[M+K]+ 172.01190 131.8
[M+H-H2O]+ 116.04600 118.9
[M+HCOO]- 178.04694 149.3
[M+CH3COO]- 192.06259 178.1
[M+Na-2H]- 154.02341 127.9
[M]+ 133.04819 121.1
[M]- 133.04929 121.1
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