CID 13873112

2-chloro-3,4-dimethoxypyridine

Structural Information

Molecular Formula
C7H8ClNO2
SMILES
COC1=C(C(=NC=C1)Cl)OC
InChI
InChI=1S/C7H8ClNO2/c1-10-5-3-4-9-7(8)6(5)11-2/h3-4H,1-2H3
InChIKey
USSXRSGDCHLUDK-UHFFFAOYSA-N
Compound name
2-chloro-3,4-dimethoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

173.02435 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.03163 130.2
[M+Na]+ 196.01357 145.1
[M+NH4]+ 191.05817 139.1
[M+K]+ 211.98751 138.3
[M-H]- 172.01707 132.0
[M+Na-2H]- 193.99902 138.0
[M]+ 173.02380 133.2
[M]- 173.02490 133.2
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