CID 44871428

3-chloro-n-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide

Structural Information

Molecular Formula
C15H13Cl2NO3
SMILES
COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)Cl)Cl
InChI
InChI=1S/C15H13Cl2NO3/c1-20-13-5-3-9(7-11(13)16)15(19)18-10-4-6-14(21-2)12(17)8-10/h3-8H,1-2H3,(H,18,19)
InChIKey
UUJCMVVYVUASKY-UHFFFAOYSA-N
Compound name
3-chloro-N-(3-chloro-4-methoxyphenyl)-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.02725 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.03453 168.6
[M+Na]+ 348.01647 178.7
[M-H]- 324.01997 175.4
[M+NH4]+ 343.06107 184.4
[M+K]+ 363.99041 173.3
[M+H-H2O]+ 308.02451 162.8
[M+HCOO]- 370.02545 184.0
[M+CH3COO]- 384.04110 208.1
[M+Na-2H]- 346.00192 171.3
[M]+ 325.02670 175.5
[M]- 325.02780 175.5
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.