CID 6410617

81198-23-4

Structural Information

Molecular Formula
C11H5ClN2O
SMILES
C1=CC=C2C(=C1)C3=NN=C(C=C3C2=O)Cl
InChI
InChI=1S/C11H5ClN2O/c12-9-5-8-10(14-13-9)6-3-1-2-4-7(6)11(8)15/h1-5H
InChIKey
KCYFISVHLKCHRM-UHFFFAOYSA-N
Compound name
3-chloroindeno[1,2-c]pyridazin-5-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

216.00903 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.01631 141.3
[M+Na]+ 238.99825 158.0
[M+NH4]+ 234.04285 151.4
[M+K]+ 254.97219 151.3
[M-H]- 215.00175 143.9
[M+Na-2H]- 236.98370 148.6
[M]+ 216.00848 144.9
[M]- 216.00958 144.9
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.