CID 3829936

1-(1-benzoyl-7-methoxypyrrolo[1,2-a]quinolin-3-yl)ethanone

Structural Information

Molecular Formula
C22H17NO3
SMILES
CC(=O)C1=C2C=CC3=C(N2C(=C1)C(=O)C4=CC=CC=C4)C=CC(=C3)OC
InChI
InChI=1S/C22H17NO3/c1-14(24)18-13-21(22(25)15-6-4-3-5-7-15)23-19-11-9-17(26-2)12-16(19)8-10-20(18)23/h3-13H,1-2H3
InChIKey
PGVXHPIBNUXIRS-UHFFFAOYSA-N
Compound name
1-(1-benzoyl-7-methoxypyrrolo[1,2-a]quinolin-3-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.12085 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.12813 180.0
[M+Na]+ 366.11007 196.3
[M+NH4]+ 361.15467 188.4
[M+K]+ 382.08401 189.8
[M-H]- 342.11357 184.7
[M+Na-2H]- 364.09552 187.8
[M]+ 343.12030 183.8
[M]- 343.12140 183.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.