CID 27317

5-(2-(dimethylamino)ethoxy)-3-methyl-10,11-dihydro-5h-dibenzo(a,d)cycloheptene maleate

Structural Information

Molecular Formula
C20H25NO
SMILES
CC1=CC2=C(CCC3=CC=CC=C3C2OCCN(C)C)C=C1
InChI
InChI=1S/C20H25NO/c1-15-8-9-17-11-10-16-6-4-5-7-18(16)20(19(17)14-15)22-13-12-21(2)3/h4-9,14,20H,10-13H2,1-3H3
InChIKey
HODWYBOXZYFAJD-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[(5-methyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.1936 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.20088 169.3
[M+Na]+ 318.18282 181.3
[M+NH4]+ 313.22742 178.4
[M+K]+ 334.15676 173.9
[M-H]- 294.18632 174.1
[M+Na-2H]- 316.16827 175.7
[M]+ 295.19305 172.6
[M]- 295.19415 172.6
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.