CID 3043933

Brn 0681954

Structural Information

Molecular Formula
C20H19ClN2
SMILES
CN\1CCC/C1=C/2\C(C3=CC=CC=C3N=C2Cl)C4=CC=CC=C4
InChI
InChI=1S/C20H19ClN2/c1-23-13-7-12-17(23)19-18(14-8-3-2-4-9-14)15-10-5-6-11-16(15)22-20(19)21/h2-6,8-11,18H,7,12-13H2,1H3/b19-17-
InChIKey
JLOVYRATCSIAPC-ZPHPHTNESA-N
Compound name
(3Z)-2-chloro-3-(1-methylpyrrolidin-2-ylidene)-4-phenyl-4H-quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.1237 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.13098 177.4
[M+Na]+ 345.11292 194.4
[M+NH4]+ 340.15752 187.5
[M+K]+ 361.08686 185.3
[M-H]- 321.11642 184.2
[M+Na-2H]- 343.09837 186.5
[M]+ 322.12315 182.2
[M]- 322.12425 182.2
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.