CID 74982302

(2z)-3-(4-formyl-2-hydroxy-1h-imidazol-5-yl)-2-hydroxyprop-2-enoate

Structural Information

Molecular Formula
C7H8N2O5
SMILES
C(=C(\C(=O)O)/O)\C1C(NC(=O)N1)C=O
InChI
InChI=1S/C7H8N2O5/c10-2-4-3(8-7(14)9-4)1-5(11)6(12)13/h1-4,11H,(H,12,13)(H2,8,9,14)/b5-1+
InChIKey
JDMBWBLNFTYQHM-ORCRQEGFSA-N
Compound name
(E)-3-(5-formyl-2-oxoimidazolidin-4-yl)-2-hydroxyprop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

200.04332 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.050596 141.7
[M+Na]+ 223.032538 148.1
[M-H]- 199.036044 137.2
[M+NH4]+ 218.077143 156.7
[M+K]+ 239.006478 144.9
[M+H-H2O]+ 183.040580 135.9
[M+HCOO]- 245.041521 155.8
[M+CH3COO]- 259.057171 172.4
[M+Na-2H]- 221.017986 140.9
[M]+ 200.04277142 135.9
[M]- 200.04386858 135.9
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

No patent data available for this compound.