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]+ 325.191056 176.5
[M+Na]+ 347.172998 180.3
[M-H]- 323.176504 182.3
[M+NH4]+ 342.217603 187.3
[M+K]+ 363.146938 180.0
[M+H-H2O]+ 307.181040 167.1
[M+HCOO]- 369.181981 187.0
[M+CH3COO]- 383.197631 184.7
[M+Na-2H]- 345.158446 179.2
[M]+ 324.18323142 169.2
[M]- 324.18432858 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.