CID 15523358

N,n-bis(2-aminoethyl)glycine

Structural Information

Molecular Formula
C6H15N3O2
SMILES
C(CN(CCN)CC(=O)O)N
InChI
InChI=1S/C6H15N3O2/c7-1-3-9(4-2-8)5-6(10)11/h1-5,7-8H2,(H,10,11)
InChIKey
BKQYOENNVQBCNE-UHFFFAOYSA-N
Compound name
2-[bis(2-aminoethyl)amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

362
Patents

161.11642 Da
Monoisotopic Mass

-4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.123696 136.1
[M+Na]+ 184.105638 140.5
[M-H]- 160.109144 135.2
[M+NH4]+ 179.150243 155.1
[M+K]+ 200.079578 140.7
[M+H-H2O]+ 144.113680 129.9
[M+HCOO]- 206.114621 160.3
[M+CH3COO]- 220.130271 185.7
[M+Na-2H]- 182.091086 139.0
[M]+ 161.11587142 133.7
[M]- 161.11696858 133.7
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