CID 137672

2-(3-aminopropanamido)acetic acid hydrochloride

Structural Information

Molecular Formula
C5H10N2O3
SMILES
C(CN)C(=O)NCC(=O)O
InChI
InChI=1S/C5H10N2O3/c6-2-1-4(8)7-3-5(9)10/h1-3,6H2,(H,7,8)(H,9,10)
InChIKey
QDHYJVJAGQLHBA-UHFFFAOYSA-N
Compound name
2-(3-aminopropanoylamino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

270
Patents

146.06914 Da
Monoisotopic Mass

-3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.07642 130.1
[M+Na]+ 169.05836 135.6
[M-H]- 145.06186 128.5
[M+NH4]+ 164.10296 149.6
[M+K]+ 185.03230 135.4
[M+H-H2O]+ 129.06640 124.7
[M+HCOO]- 191.06734 153.1
[M+CH3COO]- 205.08299 176.0
[M+Na-2H]- 167.04381 133.8
[M]+ 146.06859 127.8
[M]- 146.06969 127.8
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