CID 208795

33034-97-8

Structural Information

Molecular Formula
C21H18Cl2N2O
SMILES
CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)NC3=C(C=CC=C3Cl)Cl)C
InChI
InChI=1S/C21H18Cl2N2O/c1-13-7-5-12-18(14(13)2)24-19-11-4-3-8-15(19)21(26)25-20-16(22)9-6-10-17(20)23/h3-12,24H,1-2H3,(H,25,26)
InChIKey
HXAQFGBWPLZLMY-UHFFFAOYSA-N
Compound name
N-(2,6-dichlorophenyl)-2-(2,3-dimethylanilino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.07962 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.086896 191.0
[M+Na]+ 407.068838 199.9
[M-H]- 383.072344 200.1
[M+NH4]+ 402.113443 203.7
[M+K]+ 423.042778 191.7
[M+H-H2O]+ 367.076880 183.0
[M+HCOO]- 429.077821 206.0
[M+CH3COO]- 443.093471 201.2
[M+Na-2H]- 405.054286 192.2
[M]+ 384.07907142 194.6
[M]- 384.08016858 194.6
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.