CID 78083

2-(dichloromethyl)pyridine

Structural Information

Molecular Formula
C6H5Cl2N
SMILES
C1=CC=NC(=C1)C(Cl)Cl
InChI
InChI=1S/C6H5Cl2N/c7-6(8)5-3-1-2-4-9-5/h1-4,6H
InChIKey
FOXDMOFYUBDIFD-UHFFFAOYSA-N
Compound name
2-(dichloromethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

718
Patents

160.9799 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.98718 126.8
[M+Na]+ 183.96912 142.1
[M+NH4]+ 179.01372 136.9
[M+K]+ 199.94306 134.2
[M-H]- 159.97262 129.1
[M+Na-2H]- 181.95457 135.7
[M]+ 160.97935 130.3
[M]- 160.98045 130.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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