CID 22452345

2,4-dichloropyridine-3-carboxamide

Structural Information

Molecular Formula
C6H4Cl2N2O
SMILES
C1=CN=C(C(=C1Cl)C(=O)N)Cl
InChI
InChI=1S/C6H4Cl2N2O/c7-3-1-2-10-5(8)4(3)6(9)11/h1-2H,(H2,9,11)
InChIKey
SBNBNPZOICXBQI-UHFFFAOYSA-N
Compound name
2,4-dichloropyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

189.97006 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.97734 132.5
[M+Na]+ 212.95928 143.2
[M-H]- 188.96278 134.3
[M+NH4]+ 208.00388 151.8
[M+K]+ 228.93322 138.5
[M+H-H2O]+ 172.96732 128.1
[M+HCOO]- 234.96826 146.8
[M+CH3COO]- 248.98391 181.9
[M+Na-2H]- 210.94473 137.7
[M]+ 189.96951 133.9
[M]- 189.97061 133.9
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

patents stripe