CID 1991128

2-chloro-4-methoxypyridine

Structural Information

Molecular Formula
C6H6ClNO
SMILES
COC1=CC(=NC=C1)Cl
InChI
InChI=1S/C6H6ClNO/c1-9-5-2-3-8-6(7)4-5/h2-4H,1H3
InChIKey
PMTPFBWHUOWTNN-UHFFFAOYSA-N
Compound name
2-chloro-4-methoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

631
Patents

143.0138 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.02108 123.0
[M+Na]+ 166.00302 138.1
[M+NH4]+ 161.04762 132.6
[M+K]+ 181.97696 130.8
[M-H]- 142.00652 125.2
[M+Na-2H]- 163.98847 131.7
[M]+ 143.01325 126.1
[M]- 143.01435 126.1
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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