CID 11629769

1,2-dihydro-1,10-phenanthrolin-2-one

Structural Information

Molecular Formula
C12H8N2O
SMILES
C1=CC2=C(C3=C(C=C2)C=CC(=O)N3)N=C1
InChI
InChI=1S/C12H8N2O/c15-10-6-5-9-4-3-8-2-1-7-13-11(8)12(9)14-10/h1-7H,(H,14,15)
InChIKey
FBKKYZMTAAQTJO-UHFFFAOYSA-N
Compound name
1H-1,10-phenanthrolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

236
Patents

196.06366 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.07094 138.1
[M+Na]+ 219.05288 149.9
[M-H]- 195.05638 140.4
[M+NH4]+ 214.09748 156.4
[M+K]+ 235.02682 144.0
[M+H-H2O]+ 179.06092 130.4
[M+HCOO]- 241.06186 159.0
[M+CH3COO]- 255.07751 151.5
[M+Na-2H]- 217.03833 150.3
[M]+ 196.06311 138.7
[M]- 196.06421 138.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe