CID 478776

5-ethyl-4-methyl-7-pyridin-4-yl-2,5-dihydro-pyrrolo[3,2-c]quinolin-3-one

Structural Information

Molecular Formula
C19H17N3O
SMILES
CCN1C(=C2C(=O)CN=C2C3=C1C=C(C=C3)C4=CC=NC=C4)C
InChI
InChI=1S/C19H17N3O/c1-3-22-12(2)18-17(23)11-21-19(18)15-5-4-14(10-16(15)22)13-6-8-20-9-7-13/h4-10H,3,11H2,1-2H3
InChIKey
BJYHNUJFPMMXBU-UHFFFAOYSA-N
Compound name
5-ethyl-4-methyl-7-pyridin-4-yl-2H-pyrrolo[3,2-c]quinolin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

303.13718 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.14446 174.3
[M+Na]+ 326.12640 185.1
[M-H]- 302.12990 179.4
[M+NH4]+ 321.17100 189.4
[M+K]+ 342.10034 178.2
[M+H-H2O]+ 286.13444 164.2
[M+HCOO]- 348.13538 192.0
[M+CH3COO]- 362.15103 185.4
[M+Na-2H]- 324.11185 177.6
[M]+ 303.13663 175.9
[M]- 303.13773 175.9
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

No patent data available for this compound.