CID 5492050

2-hydroxy-2-butenedial

Structural Information

Molecular Formula
C4H4O3
SMILES
C(=C\O)\C(=O)C=O
InChI
InChI=1S/C4H4O3/c5-2-1-4(7)3-6/h1-3,5H/b2-1-
InChIKey
ZLWNFOVEHWUAJI-UPHRSURJSA-N
Compound name
(Z)-4-hydroxy-2-oxobut-3-enal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

100.016045 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.02332 117.3
[M+Na]+ 123.00526 127.1
[M+NH4]+ 118.04987 124.0
[M+K]+ 138.97920 123.0
[M-H]- 99.008769 115.0
[M+Na-2H]- 120.99071 120.2
[M]+ 100.01550 117.6
[M]- 100.01659 117.6
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.