CID 3312601

5h-indeno[1,2-b]quinolin-10(11h)-one

Structural Information

Molecular Formula
C16H11NO
SMILES
C1C2=CC=CC=C2C3=C1C(=O)C4=CC=CC=C4N3
InChI
InChI=1S/C16H11NO/c18-16-12-7-3-4-8-14(12)17-15-11-6-2-1-5-10(11)9-13(15)16/h1-8H,9H2,(H,17,18)
InChIKey
VSSBKIZSYSOAIW-UHFFFAOYSA-N
Compound name
5,11-dihydroindeno[1,2-b]quinolin-10-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

233.08406 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.09134 149.0
[M+Na]+ 256.07328 160.1
[M-H]- 232.07678 153.6
[M+NH4]+ 251.11788 170.1
[M+K]+ 272.04722 153.2
[M+H-H2O]+ 216.08132 142.2
[M+HCOO]- 278.08226 169.0
[M+CH3COO]- 292.09791 162.1
[M+Na-2H]- 254.05873 157.1
[M]+ 233.08351 149.0
[M]- 233.08461 149.0
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