CID 79467738

4-(3,3-diethoxypropyl)morpholin-3-one

Structural Information

Molecular Formula
C11H21NO4
SMILES
CCOC(CCN1CCOCC1=O)OCC
InChI
InChI=1S/C11H21NO4/c1-3-15-11(16-4-2)5-6-12-7-8-14-9-10(12)13/h11H,3-9H2,1-2H3
InChIKey
LFKVNCFVVPMPEV-UHFFFAOYSA-N
Compound name
4-(3,3-diethoxypropyl)morpholin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.14706 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.154336 153.7
[M+Na]+ 254.136278 158.0
[M-H]- 230.139784 155.3
[M+NH4]+ 249.180883 168.8
[M+K]+ 270.110218 159.0
[M+H-H2O]+ 214.144320 146.3
[M+HCOO]- 276.145261 171.1
[M+CH3COO]- 290.160911 190.4
[M+Na-2H]- 252.121726 157.0
[M]+ 231.14651142 156.0
[M]- 231.14760858 156.0
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

No patent data available for this compound.