CID 5362250

2,3,4,7-tetrahydro-3,3-dimethyl-6-ethyl-1h-indolo(2,3-c)quinolin-1-one hydrochloride

Structural Information

Molecular Formula
C19H20N2O
SMILES
CCC1=NC2=C(C(=O)CC(C2)(C)C)C3=C1NC4=CC=CC=C43
InChI
InChI=1S/C19H20N2O/c1-4-12-18-16(11-7-5-6-8-13(11)21-18)17-14(20-12)9-19(2,3)10-15(17)22/h5-8,21H,4,9-10H2,1-3H3
InChIKey
JGHFGQHLHDJTGH-UHFFFAOYSA-N
Compound name
6-ethyl-3,3-dimethyl-4,7-dihydro-2H-indolo[2,3-c]quinolin-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

12
Patents

292.15756 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.16484 170.9
[M+Na]+ 315.14678 182.4
[M-H]- 291.15028 174.0
[M+NH4]+ 310.19138 190.7
[M+K]+ 331.12072 174.9
[M+H-H2O]+ 275.15482 162.8
[M+HCOO]- 337.15576 186.9
[M+CH3COO]- 351.17141 182.3
[M+Na-2H]- 313.13223 175.6
[M]+ 292.15701 171.9
[M]- 292.15811 171.9
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