CID 13578

2-(2-aminoethoxy)ethanol

Structural Information

Molecular Formula
C4H11NO2
SMILES
C(COCCO)N
InChI
InChI=1S/C4H11NO2/c5-1-3-7-4-2-6/h6H,1-5H2
InChIKey
GIAFURWZWWWBQT-UHFFFAOYSA-N
Compound name
2-(2-aminoethoxy)ethanol
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

8
References

37298
Patents

105.07898 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.086256 120.5
[M+Na]+ 128.068198 127.2
[M-H]- 104.071704 119.0
[M+NH4]+ 123.112803 142.3
[M+K]+ 144.042138 127.0
[M+H-H2O]+ 88.076240 115.9
[M+HCOO]- 150.077181 144.2
[M+CH3COO]- 164.092831 166.5
[M+Na-2H]- 126.053646 127.2
[M]+ 105.07843142 120.1
[M]- 105.07952858 120.1
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