CID 3063372

3h-indeno(2,1-c)pyridazin-3-one, 2,9-dihydro-

Structural Information

Molecular Formula
C11H8N2O
SMILES
C1C2=CC=CC=C2C3=CC(=O)NN=C31
InChI
InChI=1S/C11H8N2O/c14-11-6-9-8-4-2-1-3-7(8)5-10(9)12-13-11/h1-4,6H,5H2,(H,13,14)
InChIKey
RBKCMQDUWRRYJS-UHFFFAOYSA-N
Compound name
2,9-dihydroindeno[2,1-c]pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.06366 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.07094 135.8
[M+Na]+ 207.05288 147.0
[M-H]- 183.05638 138.0
[M+NH4]+ 202.09748 156.5
[M+K]+ 223.02682 141.8
[M+H-H2O]+ 167.06092 129.0
[M+HCOO]- 229.06186 156.6
[M+CH3COO]- 243.07751 149.5
[M+Na-2H]- 205.03833 144.5
[M]+ 184.06311 135.5
[M]- 184.06421 135.5
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

No patent data available for this compound.