CID 36874

34812-32-3

Structural Information

Molecular Formula
C14H18ClNO4
SMILES
C1COCCN1CCOC(=O)COC2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H18ClNO4/c15-12-1-3-13(4-2-12)20-11-14(17)19-10-7-16-5-8-18-9-6-16/h1-4H,5-11H2
InChIKey
PLAGADAOXYZAML-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl 2-(4-chlorophenoxy)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.09244 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.099716 166.1
[M+Na]+ 322.081658 171.2
[M-H]- 298.085164 170.8
[M+NH4]+ 317.126263 178.8
[M+K]+ 338.055598 169.1
[M+H-H2O]+ 282.089700 157.9
[M+HCOO]- 344.090641 179.4
[M+CH3COO]- 358.106291 198.1
[M+Na-2H]- 320.067106 169.7
[M]+ 299.09189142 168.8
[M]- 299.09298858 168.8
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.