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]+ 232.15434 153.7
[M+Na]+ 254.13628 158.0
[M-H]- 230.13978 155.3
[M+NH4]+ 249.18088 168.8
[M+K]+ 270.11022 159.0
[M+H-H2O]+ 214.14432 146.3
[M+HCOO]- 276.14526 171.1
[M+CH3COO]- 290.16091 190.4
[M+Na-2H]- 252.12173 157.0
[M]+ 231.14651 156.0
[M]- 231.14761 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.