CID 21752860

(z)-2-methylureidoacrylate

Structural Information

Molecular Formula
C5H8N2O3
SMILES
C/C(=C/NC(=O)N)/C(=O)O
InChI
InChI=1S/C5H8N2O3/c1-3(4(8)9)2-7-5(6)10/h2H,1H3,(H,8,9)(H3,6,7,10)/b3-2-
InChIKey
XHTOIFCGKIBYRK-IHWYPQMZSA-N
Compound name
(Z)-3-(carbamoylamino)-2-methylprop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

144.0535 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.06078 129.6
[M+Na]+ 167.04272 135.3
[M-H]- 143.04622 128.2
[M+NH4]+ 162.08732 149.1
[M+K]+ 183.01666 135.0
[M+H-H2O]+ 127.05076 124.4
[M+HCOO]- 189.05170 151.9
[M+CH3COO]- 203.06735 175.4
[M+Na-2H]- 165.02817 132.0
[M]+ 144.05295 125.9
[M]- 144.05405 125.9
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