CID 6480484

2-hydroxy-1-(morpholin-4-yl)ethan-1-one

Structural Information

Molecular Formula
C6H11NO3
SMILES
C1COCCN1C(=O)CO
InChI
InChI=1S/C6H11NO3/c8-5-6(9)7-1-3-10-4-2-7/h8H,1-5H2
InChIKey
PHCSTEJVICOGEJ-UHFFFAOYSA-N
Compound name
2-hydroxy-1-morpholin-4-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

346
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 129.5
[M+Na]+ 168.06312 134.7
[M-H]- 144.06662 130.2
[M+NH4]+ 163.10772 147.1
[M+K]+ 184.03706 135.5
[M+H-H2O]+ 128.07116 123.3
[M+HCOO]- 190.07210 146.8
[M+CH3COO]- 204.08775 168.7
[M+Na-2H]- 166.04857 135.5
[M]+ 145.07335 126.1
[M]- 145.07445 126.1
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