CID 6409790

6-chloro-4-methyl-3-phenylpyridazine

Structural Information

Molecular Formula
C11H9ClN2
SMILES
CC1=CC(=NN=C1C2=CC=CC=C2)Cl
InChI
InChI=1S/C11H9ClN2/c1-8-7-10(12)13-14-11(8)9-5-3-2-4-6-9/h2-7H,1H3
InChIKey
SLWRMNONFLILEO-UHFFFAOYSA-N
Compound name
6-chloro-4-methyl-3-phenylpyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

204.04543 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.052706 140.8
[M+Na]+ 227.034648 151.4
[M-H]- 203.038154 144.9
[M+NH4]+ 222.079253 158.1
[M+K]+ 243.008588 146.0
[M+H-H2O]+ 187.042690 132.9
[M+HCOO]- 249.043631 158.7
[M+CH3COO]- 263.059281 154.1
[M+Na-2H]- 225.020096 148.7
[M]+ 204.04488142 142.5
[M]- 204.04597858 142.5
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