CID 306610

312704-46-4

Structural Information

Molecular Formula
C13H10Cl2N2O
SMILES
CC1=NC(=CC=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C13H10Cl2N2O/c1-8-3-2-4-12(16-8)17-13(18)10-6-5-9(14)7-11(10)15/h2-7H,1H3,(H,16,17,18)
InChIKey
UNTZDJSIWHDWON-UHFFFAOYSA-N
Compound name
2,4-dichloro-N-(6-methyl-2-pyridinyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.01703 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.024306 158.3
[M+Na]+ 303.006248 168.5
[M-H]- 279.009754 163.4
[M+NH4]+ 298.050853 174.3
[M+K]+ 318.980188 162.0
[M+H-H2O]+ 263.014290 151.7
[M+HCOO]- 325.015231 172.4
[M+CH3COO]- 339.030881 199.5
[M+Na-2H]- 300.991696 162.7
[M]+ 280.01648142 161.5
[M]- 280.01757858 161.5
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.