CID 3054152

Ita 372

Structural Information

Molecular Formula
C14H18ClN3O4
SMILES
C1COCCN1CNC(=O)NC(=O)COC2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H18ClN3O4/c15-11-1-3-12(4-2-11)22-9-13(19)17-14(20)16-10-18-5-7-21-8-6-18/h1-4H,5-10H2,(H2,16,17,19,20)
InChIKey
NNXDKWUYRKHIOD-UHFFFAOYSA-N
Compound name
2-(4-chlorophenoxy)-N-(morpholin-4-ylmethylcarbamoyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

327.09857 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.10585 173.6
[M+Na]+ 350.08779 183.0
[M+NH4]+ 345.13239 179.2
[M+K]+ 366.06173 178.1
[M-H]- 326.09129 177.1
[M+Na-2H]- 348.07324 178.1
[M]+ 327.09802 175.7
[M]- 327.09912 175.7
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