CID 14685183

3-chloro-6-methoxy-4-methylpyridazine

Structural Information

Molecular Formula
C6H7ClN2O
SMILES
CC1=CC(=NN=C1Cl)OC
InChI
InChI=1S/C6H7ClN2O/c1-4-3-5(10-2)8-9-6(4)7/h3H,1-2H3
InChIKey
KKUVFQSMYKCFAB-UHFFFAOYSA-N
Compound name
3-chloro-6-methoxy-4-methylpyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

158.02469 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.03197 127.5
[M+Na]+ 181.01391 142.7
[M+NH4]+ 176.05851 136.2
[M+K]+ 196.98785 135.9
[M-H]- 157.01741 128.9
[M+Na-2H]- 178.99936 135.4
[M]+ 158.02414 130.4
[M]- 158.02524 130.4
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