CID 202912

9,10-ethanoanthracene, 9,10-dihydro-11-(2-(dimethylamino)ethoxy)-, maleate

Structural Information

Molecular Formula
C20H23NO
SMILES
CN(C)CCOC1CC2C3=CC=CC=C3C1C4=CC=CC=C24
InChI
InChI=1S/C20H23NO/c1-21(2)11-12-22-19-13-18-14-7-3-5-9-16(14)20(19)17-10-6-4-8-15(17)18/h3-10,18-20H,11-13H2,1-2H3
InChIKey
ICEFNELLCZKSFR-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyloxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

293.17798 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.185256 167.3
[M+Na]+ 316.167198 170.8
[M-H]- 292.170704 170.2
[M+NH4]+ 311.211803 187.5
[M+K]+ 332.141138 167.1
[M+H-H2O]+ 276.175240 158.3
[M+HCOO]- 338.176181 181.3
[M+CH3COO]- 352.191831 176.9
[M+Na-2H]- 314.152646 176.1
[M]+ 293.17743142 170.9
[M]- 293.17852858 170.9
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

patents stripe