CID 215667

Brn 0415123

Structural Information

Molecular Formula
C19H24N2O
SMILES
CCCCNC(=O)C1=C2CCCCCC2=NC3=CC=CC=C31
InChI
InChI=1S/C19H24N2O/c1-2-3-13-20-19(22)18-14-9-5-4-6-11-16(14)21-17-12-8-7-10-15(17)18/h7-8,10,12H,2-6,9,11,13H2,1H3,(H,20,22)
InChIKey
XCGGIKFTXJLLSY-UHFFFAOYSA-N
Compound name
N-butyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18887 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.19615 170.1
[M+Na]+ 319.17809 180.3
[M+NH4]+ 314.22269 177.9
[M+K]+ 335.15203 173.6
[M-H]- 295.18159 173.1
[M+Na-2H]- 317.16354 175.0
[M]+ 296.18832 172.4
[M]- 296.18942 172.4
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.