CID 24017273

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

Structural Information

Molecular Formula
C15H13Cl2NO2
SMILES
CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)Cl)Cl
InChI
InChI=1S/C15H13Cl2NO2/c1-9-3-5-11(8-12(9)16)18-15(19)10-4-6-14(20-2)13(17)7-10/h3-8H,1-2H3,(H,18,19)
InChIKey
CPCAFKITQYJJNX-UHFFFAOYSA-N
Compound name
3-chloro-N-(3-chloro-4-methylphenyl)-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.03235 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.03963 166.1
[M+Na]+ 332.02157 176.3
[M-H]- 308.02507 172.8
[M+NH4]+ 327.06617 182.6
[M+K]+ 347.99551 170.2
[M+H-H2O]+ 292.02961 160.4
[M+HCOO]- 354.03055 181.2
[M+CH3COO]- 368.04620 206.0
[M+Na-2H]- 330.00702 168.7
[M]+ 309.03180 171.5
[M]- 309.03290 171.5
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.