CID 215689

36068-71-0

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CC1=CC2=C(C=C1)N=C3CCCCCC3=C2C(=O)N4CCOCC4
InChI
InChI=1S/C20H24N2O2/c1-14-7-8-18-16(13-14)19(20(23)22-9-11-24-12-10-22)15-5-3-2-4-6-17(15)21-18/h7-8,13H,2-6,9-12H2,1H3
InChIKey
LXIVDKCWMUPUHD-UHFFFAOYSA-N
Compound name
(2-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.19106 176.5
[M+Na]+ 347.17300 180.3
[M-H]- 323.17650 182.3
[M+NH4]+ 342.21760 187.3
[M+K]+ 363.14694 180.0
[M+H-H2O]+ 307.18104 167.1
[M+HCOO]- 369.18198 187.0
[M+CH3COO]- 383.19763 184.7
[M+Na-2H]- 345.15845 179.2
[M]+ 324.18323 169.2
[M]- 324.18433 169.2
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.