CID 687085

2-chloro-n-(3-methoxyphenyl)benzamide

Structural Information

Molecular Formula
C14H12ClNO2
SMILES
COC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2Cl
InChI
InChI=1S/C14H12ClNO2/c1-18-11-6-4-5-10(9-11)16-14(17)12-7-2-3-8-13(12)15/h2-9H,1H3,(H,16,17)
InChIKey
VDCFAQLSVZRGAM-UHFFFAOYSA-N
Compound name
2-chloro-N-(3-methoxyphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

4
Patents

261.05566 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.06294 156.5
[M+Na]+ 284.04488 171.6
[M+NH4]+ 279.08948 165.4
[M+K]+ 300.01882 163.4
[M-H]- 260.04838 161.6
[M+Na-2H]- 282.03033 166.2
[M]+ 261.05511 160.5
[M]- 261.05621 160.5
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

patents stripe