CID 203571

14692-49-0

Structural Information

Molecular Formula
C20H23N
SMILES
CN(C)CCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24
InChI
InChI=1S/C20H23N/c1-21(2)12-11-14-13-19-15-7-3-5-9-17(15)20(14)18-10-6-4-8-16(18)19/h3-10,14,19-20H,11-13H2,1-2H3
InChIKey
CNOPQXJWNILWRF-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

277.18304 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.190316 164.2
[M+Na]+ 300.172258 167.9
[M-H]- 276.175764 167.1
[M+NH4]+ 295.216863 185.1
[M+K]+ 316.146198 163.4
[M+H-H2O]+ 260.180300 155.3
[M+HCOO]- 322.181241 178.1
[M+CH3COO]- 336.196891 174.0
[M+Na-2H]- 298.157706 172.8
[M]+ 277.18249142 166.4
[M]- 277.18358858 166.4
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

patents stripe