CID 203558

Piperidine, 1-(2-(2-(p-fluorobenzyl)inden-3-yl)ethyl)-, hydrochloride

Structural Information

Molecular Formula
C23H26FN
SMILES
C1CCN(CC1)CCC2=C(CC3=CC=CC=C32)CC4=CC=C(C=C4)F
InChI
InChI=1S/C23H26FN/c24-21-10-8-18(9-11-21)16-20-17-19-6-2-3-7-22(19)23(20)12-15-25-13-4-1-5-14-25/h2-3,6-11H,1,4-5,12-17H2
InChIKey
XWVCZAJSYICZHC-UHFFFAOYSA-N
Compound name
1-[2-[2-[(4-fluorophenyl)methyl]-3H-inden-1-yl]ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.20493 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.21221 183.2
[M+Na]+ 358.19415 188.3
[M-H]- 334.19765 189.8
[M+NH4]+ 353.23875 197.7
[M+K]+ 374.16809 180.7
[M+H-H2O]+ 318.20219 172.2
[M+HCOO]- 380.20313 199.6
[M+CH3COO]- 394.21878 192.2
[M+Na-2H]- 356.17960 182.7
[M]+ 335.20438 178.3
[M]- 335.20548 178.3
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.