CID 3053868

Anc 116

Structural Information

Molecular Formula
C14H28N2O4
SMILES
C[N+]1(CCOCC1)CCOC(=O)C[N+]2(CCOCC2)C
InChI
InChI=1S/C14H28N2O4/c1-15(3-8-18-9-4-15)7-12-20-14(17)13-16(2)5-10-19-11-6-16/h3-13H2,1-2H3/q+2
InChIKey
CVELGGSJSWBITK-UHFFFAOYSA-N
Compound name
2-(4-methylmorpholin-4-ium-4-yl)ethyl 2-(4-methylmorpholin-4-ium-4-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.2049 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.21218 167.3
[M+Na]+ 311.19412 180.2
[M+NH4]+ 306.23872 178.4
[M+K]+ 327.16806 172.9
[M-H]- 287.19762 174.3
[M+Na-2H]- 309.17957 174.6
[M]+ 288.20435 171.9
[M]- 288.20545 171.9
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.