CID 70811

2,3,4,5-tetrachloro-6-(trichloromethyl)pyridine

Structural Information

Molecular Formula
C6Cl7N
SMILES
C1(=C(C(=NC(=C1Cl)Cl)C(Cl)(Cl)Cl)Cl)Cl
InChI
InChI=1S/C6Cl7N/c7-1-2(8)4(6(11,12)13)14-5(10)3(1)9
InChIKey
YMBFWRZKTZICHS-UHFFFAOYSA-N
Compound name
2,3,4,5-tetrachloro-6-(trichloromethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

71
Patents

330.78503 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.79231 183.8
[M+Na]+ 353.77425 195.8
[M+NH4]+ 348.81885 189.6
[M+K]+ 369.74819 187.4
[M-H]- 329.77775 182.4
[M+Na-2H]- 351.75970 186.6
[M]+ 330.78448 186.6
[M]- 330.78558 186.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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