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
1
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]+ 201.05060 141.7
[M+Na]+ 223.03254 148.1
[M-H]- 199.03604 137.2
[M+NH4]+ 218.07714 156.7
[M+K]+ 239.00648 144.9
[M+H-H2O]+ 183.04058 135.9
[M+HCOO]- 245.04152 155.8
[M+CH3COO]- 259.05717 172.4
[M+Na-2H]- 221.01799 140.9
[M]+ 200.04277 135.9
[M]- 200.04387 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.