CID 135645806

1h-pyrrolo[2,3-f]quinoline

Structural Information

Molecular Formula
C11H8N2
SMILES
C1=CNC2=CC=C3C=CN=C3C2=C1
InChI
InChI=1S/C11H8N2/c1-2-9-10(12-6-1)4-3-8-5-7-13-11(8)9/h1-7,12H
InChIKey
NJBMMMJOXRZENQ-UHFFFAOYSA-N
Compound name
6H-pyrrolo[2,3-f]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3022
Patents

168.06874 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.07602 131.7
[M+Na]+ 191.05796 142.8
[M-H]- 167.06146 133.9
[M+NH4]+ 186.10256 153.0
[M+K]+ 207.03190 137.5
[M+H-H2O]+ 151.06600 124.8
[M+HCOO]- 213.06694 153.6
[M+CH3COO]- 227.08259 145.7
[M+Na-2H]- 189.04341 142.2
[M]+ 168.06819 131.7
[M]- 168.06929 131.7
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