CID 67485

11h-indeno[1,2-b]quinoline

Structural Information

Molecular Formula
C16H11N
SMILES
C1C2=CC=CC=C2C3=NC4=CC=CC=C4C=C31
InChI
InChI=1S/C16H11N/c1-3-7-14-11(5-1)9-13-10-12-6-2-4-8-15(12)17-16(13)14/h1-8,10H,9H2
InChIKey
KUZOQBPSADEASZ-UHFFFAOYSA-N
Compound name
11H-indeno[1,2-b]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

20
Patents

217.08914 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.096416 145.9
[M+Na]+ 240.078358 156.4
[M-H]- 216.081864 151.4
[M+NH4]+ 235.122963 168.1
[M+K]+ 256.052298 150.2
[M+H-H2O]+ 200.086400 138.5
[M+HCOO]- 262.087341 167.1
[M+CH3COO]- 276.102991 159.5
[M+Na-2H]- 238.063806 155.0
[M]+ 217.08859142 146.5
[M]- 217.08968858 146.5
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