CID 16432

9-(3-piperidino-1-propynyl)fluoren-9-ol hydrochloride

Structural Information

Molecular Formula
C21H21NO
SMILES
C1CCN(CC1)CC#CC2(C3=CC=CC=C3C4=CC=CC=C42)O
InChI
InChI=1S/C21H21NO/c23-21(13-8-16-22-14-6-1-7-15-22)19-11-4-2-9-17(19)18-10-3-5-12-20(18)21/h2-5,9-12,23H,1,6-7,14-16H2
InChIKey
CSYSCFUFWVWQKH-UHFFFAOYSA-N
Compound name
9-(3-piperidin-1-ylprop-1-ynyl)fluoren-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.16232 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.16960 179.2
[M+Na]+ 326.15154 189.5
[M-H]- 302.15504 181.6
[M+NH4]+ 321.19614 195.5
[M+K]+ 342.12548 176.6
[M+H-H2O]+ 286.15958 164.8
[M+HCOO]- 348.16052 189.6
[M+CH3COO]- 362.17617 187.2
[M+Na-2H]- 324.13699 180.9
[M]+ 303.16177 169.7
[M]- 303.16287 169.7
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.