CID 203907

Piperidine, 4-((10,11-dihydro-5h-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-propyl-, maleate (1:1)

Structural Information

Molecular Formula
C23H29NO
SMILES
CCCN1CCC(CC1)OC2C3=CC=CC=C3CCC4=CC=CC=C24
InChI
InChI=1S/C23H29NO/c1-2-15-24-16-13-20(14-17-24)25-23-21-9-5-3-7-18(21)11-12-19-8-4-6-10-22(19)23/h3-10,20,23H,2,11-17H2,1H3
InChIKey
HHUQTFYJGHALKN-UHFFFAOYSA-N
Compound name
1-propyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

335.2249 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.232176 182.8
[M+Na]+ 358.214118 186.1
[M-H]- 334.217624 189.1
[M+NH4]+ 353.258723 195.9
[M+K]+ 374.188058 183.7
[M+H-H2O]+ 318.222160 174.5
[M+HCOO]- 380.223101 196.4
[M+CH3COO]- 394.238751 191.0
[M+Na-2H]- 356.199566 185.3
[M]+ 335.22435142 176.6
[M]- 335.22544858 176.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.