CID 3047628

3(2h)-pyridazinone, 6-methyl-5-phenyl-

Structural Information

Molecular Formula
C11H10N2O
SMILES
CC1=NNC(=O)C=C1C2=CC=CC=C2
InChI
InChI=1S/C11H10N2O/c1-8-10(7-11(14)13-12-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14)
InChIKey
DPSJEWYEDAVZHV-UHFFFAOYSA-N
Compound name
3-methyl-4-phenyl-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

186.07932 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.08660 138.3
[M+Na]+ 209.06854 148.1
[M-H]- 185.07204 141.6
[M+NH4]+ 204.11314 154.8
[M+K]+ 225.04248 143.4
[M+H-H2O]+ 169.07658 130.3
[M+HCOO]- 231.07752 159.9
[M+CH3COO]- 245.09317 151.4
[M+Na-2H]- 207.05399 146.2
[M]+ 186.07877 137.0
[M]- 186.07987 137.0
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

No patent data available for this compound.