CID 198498

66142-87-8

Structural Information

Molecular Formula
C22H26N2O
SMILES
CCC(=O)N(C1CCN2CCC3=CC=CC=C3C2C1)C4=CC=CC=C4
InChI
InChI=1S/C22H26N2O/c1-2-22(25)24(18-9-4-3-5-10-18)19-13-15-23-14-12-17-8-6-7-11-20(17)21(23)16-19/h3-11,19,21H,2,12-16H2,1H3
InChIKey
INISVGFBGYOYGS-UHFFFAOYSA-N
Compound name
N-(2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

334.2045 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.21178 180.4
[M+Na]+ 357.19372 182.8
[M-H]- 333.19722 186.4
[M+NH4]+ 352.23832 193.9
[M+K]+ 373.16766 178.0
[M+H-H2O]+ 317.20176 169.6
[M+HCOO]- 379.20270 195.0
[M+CH3COO]- 393.21835 188.6
[M+Na-2H]- 355.17917 183.3
[M]+ 334.20395 175.3
[M]- 334.20505 175.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.