CID 108950

60487-26-5

Structural Information

Molecular Formula
C8H20N2O3
SMILES
C(CN(CCO)CCO)NCCO
InChI
InChI=1S/C8H20N2O3/c11-6-2-9-1-3-10(4-7-12)5-8-13/h9,11-13H,1-8H2
InChIKey
AJTNPTIVLIQFSR-UHFFFAOYSA-N
Compound name
2-[2-[bis(2-hydroxyethyl)amino]ethylamino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

502
Patents

192.1474 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.15468 144.9
[M+Na]+ 215.13662 148.2
[M-H]- 191.14012 141.7
[M+NH4]+ 210.18122 162.2
[M+K]+ 231.11056 147.5
[M+H-H2O]+ 175.14466 138.8
[M+HCOO]- 237.14560 166.7
[M+CH3COO]- 251.16125 184.8
[M+Na-2H]- 213.12207 149.0
[M]+ 192.14685 145.1
[M]- 192.14795 145.1
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