CID 215645

6-methyl-5-phenyl-4,5-dihydropyridazin-3(2h)-one

Structural Information

Molecular Formula
C11H12N2O
SMILES
CC1=NNC(=O)CC1C2=CC=CC=C2
InChI
InChI=1S/C11H12N2O/c1-8-10(7-11(14)13-12-8)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,13,14)
InChIKey
SKQOLQPPNXAWFM-UHFFFAOYSA-N
Compound name
3-methyl-4-phenyl-4,5-dihydro-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.09496 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10224 141.1
[M+Na]+ 211.08418 148.8
[M-H]- 187.08768 143.7
[M+NH4]+ 206.12878 157.3
[M+K]+ 227.05812 144.6
[M+H-H2O]+ 171.09222 133.1
[M+HCOO]- 233.09316 159.9
[M+CH3COO]- 247.10881 179.9
[M+Na-2H]- 209.06963 147.0
[M]+ 188.09441 136.9
[M]- 188.09551 136.9
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.