CID 1751484

Ureidoacrylate

Structural Information

Molecular Formula
C4H6N2O3
SMILES
C(=C\NC(=O)N)\C(=O)O
InChI
InChI=1S/C4H6N2O3/c5-4(9)6-2-1-3(7)8/h1-2H,(H,7,8)(H3,5,6,9)/b2-1-
InChIKey
JDSSVQWHYUVDDF-UPHRSURJSA-N
Compound name
(Z)-3-(carbamoylamino)prop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

130.03784 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.045116 124.4
[M+Na]+ 153.027058 130.7
[M-H]- 129.030564 123.1
[M+NH4]+ 148.071663 144.5
[M+K]+ 169.000998 130.2
[M+H-H2O]+ 113.035100 119.3
[M+HCOO]- 175.036041 148.0
[M+CH3COO]- 189.051691 171.4
[M+Na-2H]- 151.012506 128.7
[M]+ 130.03729142 121.0
[M]- 130.03838858 121.0
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