CID 3043934

2(1h)-quinolinone, 3,4-dihydro-3-(1-methyl-2-pyrrolidinylidene)-4-phenyl-

Structural Information

Molecular Formula
C20H20N2O
SMILES
CN\1CCC/C1=C/2\C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4
InChI
InChI=1S/C20H20N2O/c1-22-13-7-12-17(22)19-18(14-8-3-2-4-9-14)15-10-5-6-11-16(15)21-20(19)23/h2-6,8-11,18H,7,12-13H2,1H3,(H,21,23)/b19-17-
InChIKey
ZRERDNRRDYXLIL-ZPHPHTNESA-N
Compound name
(3Z)-3-(1-methylpyrrolidin-2-ylidene)-4-phenyl-1,4-dihydroquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.15756 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.16484 174.6
[M+Na]+ 327.14678 180.9
[M-H]- 303.15028 180.5
[M+NH4]+ 322.19138 188.4
[M+K]+ 343.12072 173.2
[M+H-H2O]+ 287.15482 164.8
[M+HCOO]- 349.15576 189.4
[M+CH3COO]- 363.17141 183.9
[M+Na-2H]- 325.13223 174.2
[M]+ 304.15701 167.5
[M]- 304.15811 167.5
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.