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]+ 304.144456 174.3
[M+Na]+ 326.126398 185.1
[M-H]- 302.129904 179.4
[M+NH4]+ 321.171003 189.4
[M+K]+ 342.100338 178.2
[M+H-H2O]+ 286.134440 164.2
[M+HCOO]- 348.135381 192.0
[M+CH3COO]- 362.151031 185.4
[M+Na-2H]- 324.111846 177.6
[M]+ 303.13663142 175.9
[M]- 303.13772858 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.