CID 203575

14692-53-6

Structural Information

Molecular Formula
C23H29N
SMILES
CCN(CC)CCCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24
InChI
InChI=1S/C23H29N/c1-3-24(4-2)15-9-10-17-16-22-18-11-5-7-13-20(18)23(17)21-14-8-6-12-19(21)22/h5-8,11-14,17,22-23H,3-4,9-10,15-16H2,1-2H3
InChIKey
SAQIIKRJZFZYAG-UHFFFAOYSA-N
Compound name
N,N-diethyl-3-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.23 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.23728 175.2
[M+Na]+ 342.21922 189.3
[M+NH4]+ 337.26382 187.4
[M+K]+ 358.19316 178.1
[M-H]- 318.22272 179.8
[M+Na-2H]- 340.20467 178.3
[M]+ 319.22945 178.9
[M]- 319.23055 178.9
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.