CID 222292

2-hydroxy-3-methoxybutanoic acid

Structural Information

Molecular Formula
C5H10O4
SMILES
CC(C(C(=O)O)O)OC
InChI
InChI=1S/C5H10O4/c1-3(9-2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)
InChIKey
HXGKXDWXDMCHDY-UHFFFAOYSA-N
Compound name
2-hydroxy-3-methoxybutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

134.0579 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.065176 126.5
[M+Na]+ 157.047118 132.8
[M-H]- 133.050624 124.2
[M+NH4]+ 152.091723 146.7
[M+K]+ 173.021058 133.7
[M+H-H2O]+ 117.055160 122.3
[M+HCOO]- 179.056101 145.7
[M+CH3COO]- 193.071751 168.6
[M+Na-2H]- 155.032566 129.2
[M]+ 134.05735142 126.7
[M]- 134.05844858 126.7
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