CID 34179996

(r)-6-(hydroxymethyl)morpholin-3-one

Structural Information

Molecular Formula
C5H9NO3
SMILES
C1[C@@H](OCC(=O)N1)CO
InChI
InChI=1S/C5H9NO3/c7-2-4-1-6-5(8)3-9-4/h4,7H,1-3H2,(H,6,8)/t4-/m1/s1
InChIKey
DMELBDGPDOJCTC-SCSAIBSYSA-N
Compound name
(6R)-6-(hydroxymethyl)morpholin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

131.05824 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.06552 125.3
[M+Na]+ 154.04746 135.4
[M+NH4]+ 149.09206 132.3
[M+K]+ 170.02140 131.6
[M-H]- 130.05096 125.9
[M+Na-2H]- 152.03291 128.5
[M]+ 131.05769 126.5
[M]- 131.05879 126.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe