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

0
Patents

277.18304 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.19032 164.2
[M+Na]+ 300.17226 167.9
[M-H]- 276.17576 167.1
[M+NH4]+ 295.21686 185.1
[M+K]+ 316.14620 163.4
[M+H-H2O]+ 260.18030 155.3
[M+HCOO]- 322.18124 178.1
[M+CH3COO]- 336.19689 174.0
[M+Na-2H]- 298.15771 172.8
[M]+ 277.18249 166.4
[M]- 277.18359 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