CID 95457

N-(2-hydroxyethyl)lactamide

Structural Information

Molecular Formula
C5H11NO3
SMILES
CC(C(=O)NCCO)O
InChI
InChI=1S/C5H11NO3/c1-4(8)5(9)6-2-3-7/h4,7-8H,2-3H2,1H3,(H,6,9)
InChIKey
RZCHTMXTKQHYDT-UHFFFAOYSA-N
Compound name
2-hydroxy-N-(2-hydroxyethyl)propanamide
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

2
References

3395
Patents

133.0739 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.081176 128.2
[M+Na]+ 156.063118 133.9
[M-H]- 132.066624 125.8
[M+NH4]+ 151.107723 148.3
[M+K]+ 172.037058 133.8
[M+H-H2O]+ 116.071160 123.6
[M+HCOO]- 178.072101 149.2
[M+CH3COO]- 192.087751 169.9
[M+Na-2H]- 154.048566 132.3
[M]+ 133.07335142 126.6
[M]- 133.07444858 126.6
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