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]+ 305.164836 174.6
[M+Na]+ 327.146778 180.9
[M-H]- 303.150284 180.5
[M+NH4]+ 322.191383 188.4
[M+K]+ 343.120718 173.2
[M+H-H2O]+ 287.154820 164.8
[M+HCOO]- 349.155761 189.4
[M+CH3COO]- 363.171411 183.9
[M+Na-2H]- 325.132226 174.2
[M]+ 304.15701142 167.5
[M]- 304.15810858 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.