CID 3046632

62469-27-6

Structural Information

Molecular Formula
C23H27N
SMILES
C1CCC(CC1)NCC=C2C3=CC=CC=C3CCC4=CC=CC=C42
InChI
InChI=1S/C23H27N/c1-2-10-20(11-3-1)24-17-16-23-21-12-6-4-8-18(21)14-15-19-9-5-7-13-22(19)23/h4-9,12-13,16,20,24H,1-3,10-11,14-15,17H2
InChIKey
GWUCJZPFJMULFP-UHFFFAOYSA-N
Compound name
N-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)ethyl]cyclohexanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.21436 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.221636 177.2
[M+Na]+ 340.203578 179.2
[M-H]- 316.207084 184.5
[M+NH4]+ 335.248183 191.8
[M+K]+ 356.177518 175.9
[M+H-H2O]+ 300.211620 170.4
[M+HCOO]- 362.212561 193.1
[M+CH3COO]- 376.228211 185.5
[M+Na-2H]- 338.189026 180.9
[M]+ 317.21381142 167.6
[M]- 317.21490858 167.6
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.