CID 11355450

3-(aminooxy)propanoic acid hydrochloride

Structural Information

Molecular Formula
C3H7NO3
SMILES
C(CON)C(=O)O
InChI
InChI=1S/C3H7NO3/c4-7-2-1-3(5)6/h1-2,4H2,(H,5,6)
InChIKey
AFBSAFGEGKQVFR-UHFFFAOYSA-N
Compound name
3-aminooxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

146
Patents

105.042595 Da
Monoisotopic Mass

-3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.04987 117.8
[M+Na]+ 128.03181 125.0
[M-H]- 104.03532 116.6
[M+NH4]+ 123.07642 139.5
[M+K]+ 144.00575 125.4
[M+H-H2O]+ 88.039855 113.3
[M+HCOO]- 150.04080 141.4
[M+CH3COO]- 164.05645 165.5
[M+Na-2H]- 126.01726 123.8
[M]+ 105.04205 117.2
[M]- 105.04314 117.2
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