CID 736958

N-(3-chlorophenyl)-3,4-dimethoxybenzamide

Structural Information

Molecular Formula
C15H14ClNO3
SMILES
COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)Cl)OC
InChI
InChI=1S/C15H14ClNO3/c1-19-13-7-6-10(8-14(13)20-2)15(18)17-12-5-3-4-11(16)9-12/h3-9H,1-2H3,(H,17,18)
InChIKey
OOGINWKKOKKSFT-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

291.06622 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.07350 163.3
[M+Na]+ 314.05544 172.1
[M-H]- 290.05894 170.5
[M+NH4]+ 309.10004 179.6
[M+K]+ 330.02938 167.8
[M+H-H2O]+ 274.06348 156.4
[M+HCOO]- 336.06442 183.7
[M+CH3COO]- 350.08007 202.6
[M+Na-2H]- 312.04089 167.4
[M]+ 291.06567 168.4
[M]- 291.06677 168.4
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.