CID 242935

1011-46-7

Structural Information

Molecular Formula

C₁₀H₁₀N₂O

SMILES

C1CC(=O)NN=C1C2=CC=CC=C2

InChI

InChI=1S/C10H10N2O/c13-10-7-6-9(11-12-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)

InChIKey

KSGYMLDMYPAMFV-UHFFFAOYSA-N

Compound name

3-phenyl-4,5-dihydro-1H-pyridazin-6-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 9
References: 109
Patents: 174.07932 Da
Monoisotopic Mass: 0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	175.08660	136.5
[M+Na]+	197.06854	143.7
[M-H]-	173.07204	138.8
[M+NH4]+	192.11314	152.9
[M+K]+	213.04248	139.8
[M+H-H2O]+	157.07658	128.4
[M+HCOO]-	219.07752	155.6
[M+CH3COO]-	233.09317	148.5
[M+Na-2H]-	195.05399	143.7
[M]+	174.07877	131.6
[M]-	174.07987	131.6

Literature stripe

literature stripe

Patent stripe

patents stripe