CID 727271

4-chloro-n-[2-(4-morpholinylcarbonyl)phenyl]benzamide

Structural Information

Molecular Formula
C18H17ClN2O3
SMILES
C1COCCN1C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H17ClN2O3/c19-14-7-5-13(6-8-14)17(22)20-16-4-2-1-3-15(16)18(23)21-9-11-24-12-10-21/h1-8H,9-12H2,(H,20,22)
InChIKey
QZONUDHFBFFDNZ-UHFFFAOYSA-N
Compound name
4-chloro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

344.09277 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.100046 179.6
[M+Na]+ 367.081988 184.4
[M-H]- 343.085494 187.6
[M+NH4]+ 362.126593 189.7
[M+K]+ 383.055928 180.4
[M+H-H2O]+ 327.090030 170.1
[M+HCOO]- 389.090971 192.8
[M+CH3COO]- 403.106621 209.8
[M+Na-2H]- 365.067436 181.9
[M]+ 344.09222142 178.2
[M]- 344.09331858 178.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.