CID 203581

14692-56-9

Structural Information

Molecular Formula
C21H26N2
SMILES
CN(C)CCN(C)C1CC2C3=CC=CC=C3C1C4=CC=CC=C24
InChI
InChI=1S/C21H26N2/c1-22(2)12-13-23(3)20-14-19-15-8-4-6-10-17(15)21(20)18-11-7-5-9-16(18)19/h4-11,19-21H,12-14H2,1-3H3
InChIKey
AEIYGASJIZYFAE-UHFFFAOYSA-N
Compound name
N,N,N'-trimethyl-N'-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.2096 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.21688 172.2
[M+Na]+ 329.19882 174.5
[M-H]- 305.20232 175.9
[M+NH4]+ 324.24342 192.0
[M+K]+ 345.17276 171.3
[M+H-H2O]+ 289.20686 162.7
[M+HCOO]- 351.20780 187.0
[M+CH3COO]- 365.22345 181.4
[M+Na-2H]- 327.18427 180.0
[M]+ 306.20905 175.2
[M]- 306.21015 175.2
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.