CID 12256008

2-hydroxy-3-methoxypropanoic acid

Structural Information

Molecular Formula
C4H8O4
SMILES
COCC(C(=O)O)O
InChI
InChI=1S/C4H8O4/c1-8-2-3(5)4(6)7/h3,5H,2H2,1H3,(H,6,7)
InChIKey
JFISKVPZHADVPM-UHFFFAOYSA-N
Compound name
2-hydroxy-3-methoxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

120.04226 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.04954 121.7
[M+Na]+ 143.03148 128.7
[M-H]- 119.03498 119.6
[M+NH4]+ 138.07608 142.6
[M+K]+ 159.00542 129.3
[M+H-H2O]+ 103.03952 117.7
[M+HCOO]- 165.04046 142.3
[M+CH3COO]- 179.05611 164.6
[M+Na-2H]- 141.01693 126.3
[M]+ 120.04171 122.2
[M]- 120.04281 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

No literature data available for this compound.

Patent stripe

patents stripe