CID 3087097

6h-cyclohepta(b)quinoline, 7,8,9,10-tetrahydro-2,4-dichloro-11-(4-morpholinyl)-

Structural Information

Molecular Formula
C18H20Cl2N2O
SMILES
C1CCC2=C(C3=C(C(=CC(=C3)Cl)Cl)N=C2CC1)N4CCOCC4
InChI
InChI=1S/C18H20Cl2N2O/c19-12-10-14-17(15(20)11-12)21-16-5-3-1-2-4-13(16)18(14)22-6-8-23-9-7-22/h10-11H,1-9H2
InChIKey
AKDPCGCMRFVITH-UHFFFAOYSA-N
Compound name
4-(2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.09528 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.10256 180.8
[M+Na]+ 373.08450 194.9
[M+NH4]+ 368.12910 189.8
[M+K]+ 389.05844 186.6
[M-H]- 349.08800 186.4
[M+Na-2H]- 371.06995 186.2
[M]+ 350.09473 185.2
[M]- 350.09583 185.2
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.