CID 202339

3-alpha-((3-methyl-5h-dibenzo(a,d)cyclohepten-5-yl)oxy)tropane maleate

Structural Information

Molecular Formula
C24H27NO
SMILES
CC1=CC2=C(C=C1)C=CC3=CC=CC=C3C2OC4CC5CCC(C4)N5C
InChI
InChI=1S/C24H27NO/c1-16-7-8-18-10-9-17-5-3-4-6-22(17)24(23(18)13-16)26-21-14-19-11-12-20(15-21)25(19)2/h3-10,13,19-21,24H,11-12,14-15H2,1-2H3
InChIKey
UOOYAPDETFUJIV-UHFFFAOYSA-N
Compound name
8-methyl-3-[(5-methyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaenyl)oxy]-8-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.20926 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.21654 185.4
[M+Na]+ 368.19848 198.0
[M+NH4]+ 363.24308 195.2
[M+K]+ 384.17242 191.1
[M-H]- 344.20198 190.3
[M+Na-2H]- 366.18393 189.4
[M]+ 345.20871 188.9
[M]- 345.20981 188.9
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.