CID 203569

14692-47-8

Structural Information

Molecular Formula
C22H25N
SMILES
C1CCN(CC1)CC2CC3C4=CC=CC=C4C2C5=CC=CC=C35
InChI
InChI=1S/C22H25N/c1-6-12-23(13-7-1)15-16-14-21-17-8-2-4-10-19(17)22(16)20-11-5-3-9-18(20)21/h2-5,8-11,16,21-22H,1,6-7,12-15H2
InChIKey
UXPDNEXBQDOGCB-UHFFFAOYSA-N
Compound name
1-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

303.1987 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.20598 167.9
[M+Na]+ 326.18792 169.6
[M-H]- 302.19142 170.0
[M+NH4]+ 321.23252 185.0
[M+K]+ 342.16186 163.0
[M+H-H2O]+ 286.19596 156.4
[M+HCOO]- 348.19690 175.4
[M+CH3COO]- 362.21255 175.3
[M+Na-2H]- 324.17337 174.8
[M]+ 303.19815 163.6
[M]- 303.19925 163.6
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.