CID 100612

5h-indeno(1,2-c)pyridazin-3-one, 2,3-dihydro-2-methyl-

Structural Information

Molecular Formula
C12H10N2O
SMILES
CN1C(=O)C=C2CC3=CC=CC=C3C2=N1
InChI
InChI=1S/C12H10N2O/c1-14-11(15)7-9-6-8-4-2-3-5-10(8)12(9)13-14/h2-5,7H,6H2,1H3
InChIKey
HSNQIVHKBYDSND-UHFFFAOYSA-N
Compound name
2-methyl-5H-indeno[1,2-c]pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.07932 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.08660 140.8
[M+Na]+ 221.06854 156.4
[M+NH4]+ 216.11314 150.4
[M+K]+ 237.04248 150.3
[M-H]- 197.07204 143.3
[M+Na-2H]- 219.05399 147.7
[M]+ 198.07877 143.8
[M]- 198.07987 143.8
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

patents stripe