CID 836075

2,4-dichloro-n-(3-methyl-2-pyridinyl)benzamide

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

280.01703 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.02431 159.4
[M+Na]+ 303.00625 175.7
[M+NH4]+ 298.05085 168.2
[M+K]+ 318.98019 167.0
[M-H]- 279.00975 164.0
[M+Na-2H]- 300.99170 168.9
[M]+ 280.01648 163.7
[M]- 280.01758 163.7
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.