CID 54677927

Dihydroxymaleic acid

Structural Information

Molecular Formula
C4H4O6
SMILES
C(=C(\C(=O)O)/O)(\C(=O)O)/O
InChI
InChI=1S/C4H4O6/c5-1(3(7)8)2(6)4(9)10/h5-6H,(H,7,8)(H,9,10)/b2-1-
InChIKey
BZCOSCNPHJNQBP-UPHRSURJSA-N
Compound name
(Z)-2,3-dihydroxybut-2-enedioic acid
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

56
References

8302
Patents

148.0008 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.008076 125.4
[M+Na]+ 170.990018 131.5
[M-H]- 146.993524 120.5
[M+NH4]+ 166.034623 143.2
[M+K]+ 186.963958 131.2
[M+H-H2O]+ 130.998060 121.4
[M+HCOO]- 192.999001 141.8
[M+CH3COO]- 207.014651 163.9
[M+Na-2H]- 168.975466 126.4
[M]+ 148.00025142 122.2
[M]- 148.00134858 122.2
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