CID 98759

Ethyl 2,6-dimethyl-4-morpholinepropionate

Structural Information

Molecular Formula
C11H21NO3
SMILES
CCOC(=O)CCN1CC(OC(C1)C)C
InChI
InChI=1S/C11H21NO3/c1-4-14-11(13)5-6-12-7-9(2)15-10(3)8-12/h9-10H,4-8H2,1-3H3
InChIKey
PQHKGZQMAHHJTD-UHFFFAOYSA-N
Compound name
ethyl 3-(2,6-dimethylmorpholin-4-yl)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

215.15215 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.15943 150.9
[M+Na]+ 238.14137 156.3
[M-H]- 214.14487 153.0
[M+NH4]+ 233.18597 167.1
[M+K]+ 254.11531 156.9
[M+H-H2O]+ 198.14941 144.1
[M+HCOO]- 260.15035 168.1
[M+CH3COO]- 274.16600 188.8
[M+Na-2H]- 236.12682 153.4
[M]+ 215.15160 152.1
[M]- 215.15270 152.1
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