CID 61275104

2-amino-n-(2-aminoethyl)propanamide hydrochloride

Structural Information

Molecular Formula
C5H13N3O
SMILES
CC(C(=O)NCCN)N
InChI
InChI=1S/C5H13N3O/c1-4(7)5(9)8-3-2-6/h4H,2-3,6-7H2,1H3,(H,8,9)
InChIKey
OSQSUDBBOWHAHA-UHFFFAOYSA-N
Compound name
2-amino-N-(2-aminoethyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

131.10587 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.11315 129.6
[M+Na]+ 154.09509 134.5
[M-H]- 130.09859 129.0
[M+NH4]+ 149.13969 150.0
[M+K]+ 170.06903 134.6
[M+H-H2O]+ 114.10313 123.8
[M+HCOO]- 176.10407 153.8
[M+CH3COO]- 190.11972 179.8
[M+Na-2H]- 152.08054 132.9
[M]+ 131.10532 125.2
[M]- 131.10642 125.2
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.