CID 3053862

4-morpholineacetic acid, 2-(diethylamino)ethyl ester, dihydrochloride

Structural Information

Molecular Formula
C12H24N2O3
SMILES
CCN(CC)CCOC(=O)CN1CCOCC1
InChI
InChI=1S/C12H24N2O3/c1-3-13(4-2)7-10-17-12(15)11-14-5-8-16-9-6-14/h3-11H2,1-2H3
InChIKey
ZBNMVIUUUTYHNC-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl 2-morpholin-4-ylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.1787 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.18598 160.4
[M+Na]+ 267.16792 162.7
[M-H]- 243.17142 162.9
[M+NH4]+ 262.21252 175.0
[M+K]+ 283.14186 164.3
[M+H-H2O]+ 227.17596 152.2
[M+HCOO]- 289.17690 178.8
[M+CH3COO]- 303.19255 197.9
[M+Na-2H]- 265.15337 163.3
[M]+ 244.17815 161.6
[M]- 244.17925 161.6
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.