CID 471637

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

Structural Information

Molecular Formula
C18H19ClN2O2
SMILES
C1COCCN1CC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H19ClN2O2/c19-16-7-5-14(6-8-16)18(22)20-17-4-2-1-3-15(17)13-21-9-11-23-12-10-21/h1-8H,9-13H2,(H,20,22)
InChIKey
CEDMRJIVCOBAOK-UHFFFAOYSA-N
Compound name
4-chloro-N-[2-(morpholin-4-ylmethyl)phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.1135 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.12078 177.9
[M+Na]+ 353.10272 182.7
[M-H]- 329.10622 185.6
[M+NH4]+ 348.14732 188.7
[M+K]+ 369.07666 178.0
[M+H-H2O]+ 313.11076 168.1
[M+HCOO]- 375.11170 191.6
[M+CH3COO]- 389.12735 187.3
[M+Na-2H]- 351.08817 181.1
[M]+ 330.11295 176.3
[M]- 330.11405 176.3
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.