CID 416960

Methyl 2-amino-3-hydroxypropanoate

Structural Information

Molecular Formula
C4H9NO3
SMILES
COC(=O)C(CO)N
InChI
InChI=1S/C4H9NO3/c1-8-4(7)3(5)2-6/h3,6H,2,5H2,1H3
InChIKey
ANSUDRATXSJBLY-UHFFFAOYSA-N
Compound name
methyl 2-amino-3-hydroxypropanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

14
References

5237
Patents

119.05824 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.06552 122.9
[M+Na]+ 142.04746 130.6
[M+NH4]+ 137.09206 129.3
[M+K]+ 158.02140 128.2
[M-H]- 118.05096 120.8
[M+Na-2H]- 140.03291 124.8
[M]+ 119.05769 122.8
[M]- 119.05879 122.8
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