CID 52677

Brn 0495609

Structural Information

Molecular Formula
C24H30N2
SMILES
C1CCC(CC1)NC2CN(C2)C3C4=CC=CC=C4CCC5=CC=CC=C35
InChI
InChI=1S/C24H30N2/c1-2-10-20(11-3-1)25-21-16-26(17-21)24-22-12-6-4-8-18(22)14-15-19-9-5-7-13-23(19)24/h4-9,12-13,20-21,24-25H,1-3,10-11,14-17H2
InChIKey
CRHLZDAYZHEKGL-UHFFFAOYSA-N
Compound name
N-cyclohexyl-1-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)azetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

346.2409 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.24818 187.9
[M+Na]+ 369.23012 195.2
[M+NH4]+ 364.27472 193.4
[M+K]+ 385.20406 188.3
[M-H]- 345.23362 192.4
[M+Na-2H]- 367.21557 192.3
[M]+ 346.24035 189.3
[M]- 346.24145 189.3
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.