CID 9964102

2-[(2-methoxyethyl)amino]acetic acid hydrochloride

Structural Information

Molecular Formula
C5H11NO3
SMILES
COCCNCC(=O)O
InChI
InChI=1S/C5H11NO3/c1-9-3-2-6-4-5(7)8/h6H,2-4H2,1H3,(H,7,8)
InChIKey
RHLQNMMWMDYKFY-UHFFFAOYSA-N
Compound name
2-(2-methoxyethylamino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

340
Patents

133.0739 Da
Monoisotopic Mass

-3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.08118 126.6
[M+Na]+ 156.06312 132.9
[M-H]- 132.06662 125.6
[M+NH4]+ 151.10772 147.4
[M+K]+ 172.03706 133.2
[M+H-H2O]+ 116.07116 121.7
[M+HCOO]- 178.07210 150.1
[M+CH3COO]- 192.08775 172.2
[M+Na-2H]- 154.04857 132.6
[M]+ 133.07335 127.7
[M]- 133.07445 127.7
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