CID 14357908

6-chloro-4-methoxy-3-phenylpyridazine

Structural Information

Molecular Formula
C11H9ClN2O
SMILES
COC1=CC(=NN=C1C2=CC=CC=C2)Cl
InChI
InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3
InChIKey
QQPPLPQPYYLNDE-UHFFFAOYSA-N
Compound name
6-chloro-4-methoxy-3-phenylpyridazine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

220.04034 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.04762 143.9
[M+Na]+ 243.02956 154.5
[M-H]- 219.03306 148.1
[M+NH4]+ 238.07416 160.6
[M+K]+ 259.00350 149.7
[M+H-H2O]+ 203.03760 135.9
[M+HCOO]- 265.03854 162.1
[M+CH3COO]- 279.05419 157.2
[M+Na-2H]- 241.01501 151.8
[M]+ 220.03979 147.1
[M]- 220.04089 147.1
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