CID 70661178

4-chloro-2-methoxy-6-methylpyridine

Structural Information

Molecular Formula
C7H8ClNO
SMILES
CC1=CC(=CC(=N1)OC)Cl
InChI
InChI=1S/C7H8ClNO/c1-5-3-6(8)4-7(9-5)10-2/h3-4H,1-2H3
InChIKey
FNQQGFVVLZKWNV-UHFFFAOYSA-N
Compound name
4-chloro-2-methoxy-6-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

157.02943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.036706 126.7
[M+Na]+ 180.018648 137.6
[M-H]- 156.022154 129.6
[M+NH4]+ 175.063253 147.9
[M+K]+ 195.992588 134.8
[M+H-H2O]+ 140.026690 121.7
[M+HCOO]- 202.027631 146.3
[M+CH3COO]- 216.043281 176.1
[M+Na-2H]- 178.004096 134.3
[M]+ 157.02888142 130.5
[M]- 157.02997858 130.5
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