CID 23438

Ethanaminium, 2-hydroxy-n,n-bis(2-hydroxyethyl)-n-methyl-

Structural Information

Molecular Formula
C7H18NO3
SMILES
C[N+](CCO)(CCO)CCO
InChI
InChI=1S/C7H18NO3/c1-8(2-5-9,3-6-10)4-7-11/h9-11H,2-7H2,1H3/q+1
InChIKey
FVJLCPJDDAGIJE-UHFFFAOYSA-N
Compound name
tris(2-hydroxyethyl)-methylazanium
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

7
References

3589
Patents

164.12866 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.13594 133.2
[M+Na]+ 187.11788 142.8
[M+NH4]+ 182.16248 140.7
[M+K]+ 203.09182 139.8
[M-H]- 163.12138 132.7
[M+Na-2H]- 185.10333 136.4
[M]+ 164.12811 134.4
[M]- 164.12921 134.4
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