CID 15287400

4-(2-hydroxyethyl)morpholin-3-one

Structural Information

Molecular Formula
C6H11NO3
SMILES
C1COCC(=O)N1CCO
InChI
InChI=1S/C6H11NO3/c8-3-1-7-2-4-10-5-6(7)9/h8H,1-5H2
InChIKey
NLQNYAFMZKEJEO-UHFFFAOYSA-N
Compound name
4-(2-hydroxyethyl)morpholin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

193
Patents

145.0739 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.08118 128.6
[M+Na]+ 168.06312 134.9
[M-H]- 144.06662 129.6
[M+NH4]+ 163.10772 146.6
[M+K]+ 184.03706 135.3
[M+H-H2O]+ 128.07116 122.6
[M+HCOO]- 190.07210 146.9
[M+CH3COO]- 204.08775 169.7
[M+Na-2H]- 166.04857 135.2
[M]+ 145.07335 126.4
[M]- 145.07445 126.4
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