CID 94967

2-hydroxy-n-(2-hydroxyethyl)acetamide

Structural Information

Molecular Formula
C4H9NO3
SMILES
C(CO)NC(=O)CO
InChI
InChI=1S/C4H9NO3/c6-2-1-5-4(8)3-7/h6-7H,1-3H2,(H,5,8)
InChIKey
NAOVCEBACWAEDG-UHFFFAOYSA-N
Compound name
2-hydroxy-N-(2-hydroxyethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

138
Patents

119.05824 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.06552 123.0
[M+Na]+ 142.04746 129.4
[M-H]- 118.05096 120.7
[M+NH4]+ 137.09206 143.7
[M+K]+ 158.02140 129.0
[M+H-H2O]+ 102.05550 118.5
[M+HCOO]- 164.05644 145.3
[M+CH3COO]- 178.07209 165.9
[M+Na-2H]- 140.03291 128.9
[M]+ 119.05769 121.7
[M]- 119.05879 121.7
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