CID 240763

2059932-93-1

Structural Information

Molecular Formula
C10H14N2O3
SMILES
CCOC(=O)C(C(C1=CC=NC=C1)O)N
InChI
InChI=1S/C10H14N2O3/c1-2-15-10(14)8(11)9(13)7-3-5-12-6-4-7/h3-6,8-9,13H,2,11H2,1H3
InChIKey
LOGZXTQLUHYFBJ-UHFFFAOYSA-N
Compound name
ethyl 2-amino-3-hydroxy-3-pyridin-4-ylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.10045 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.10773 147.1
[M+Na]+ 233.08967 152.1
[M-H]- 209.09317 147.2
[M+NH4]+ 228.13427 162.8
[M+K]+ 249.06361 151.1
[M+H-H2O]+ 193.09771 139.9
[M+HCOO]- 255.09865 166.8
[M+CH3COO]- 269.11430 185.9
[M+Na-2H]- 231.07512 149.8
[M]+ 210.09990 145.8
[M]- 210.10100 145.8
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.