CID 4533148

2-chloro-n-(3-chloro-4-methoxyphenyl)-2-phenylacetamide

Structural Information

Molecular Formula
C15H13Cl2NO2
SMILES
COC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)Cl)Cl
InChI
InChI=1S/C15H13Cl2NO2/c1-20-13-8-7-11(9-12(13)16)18-15(19)14(17)10-5-3-2-4-6-10/h2-9,14H,1H3,(H,18,19)
InChIKey
BKKDMADLNRAVGL-UHFFFAOYSA-N
Compound name
2-chloro-N-(3-chloro-4-methoxyphenyl)-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.03235 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.03963 166.0
[M+Na]+ 332.02157 174.1
[M-H]- 308.02507 172.1
[M+NH4]+ 327.06617 181.8
[M+K]+ 347.99551 168.3
[M+H-H2O]+ 292.02961 160.0
[M+HCOO]- 354.03055 180.2
[M+CH3COO]- 368.04620 204.5
[M+Na-2H]- 330.00702 168.9
[M]+ 309.03180 170.1
[M]- 309.03290 170.1
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.