CID 2774938

4-chloro-5-methoxy-2-methyl-2,3-dihydropyridazin-3-one

Structural Information

Molecular Formula
C6H7ClN2O2
SMILES
CN1C(=O)C(=C(C=N1)OC)Cl
InChI
InChI=1S/C6H7ClN2O2/c1-9-6(10)5(7)4(11-2)3-8-9/h3H,1-2H3
InChIKey
OGHGGBMXRUJBAF-UHFFFAOYSA-N
Compound name
4-chloro-5-methoxy-2-methylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

112
Patents

174.0196 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.026876 128.4
[M+Na]+ 197.008818 140.9
[M-H]- 173.012324 130.4
[M+NH4]+ 192.053423 147.7
[M+K]+ 212.982758 138.1
[M+H-H2O]+ 157.016860 122.6
[M+HCOO]- 219.017801 147.3
[M+CH3COO]- 233.033451 178.2
[M+Na-2H]- 194.994266 135.8
[M]+ 174.01905142 133.4
[M]- 174.02014858 133.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe