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]+ 304.169596 179.2
[M+Na]+ 326.151538 189.5
[M-H]- 302.155044 181.6
[M+NH4]+ 321.196143 195.5
[M+K]+ 342.125478 176.6
[M+H-H2O]+ 286.159580 164.8
[M+HCOO]- 348.160521 189.6
[M+CH3COO]- 362.176171 187.2
[M+Na-2H]- 324.136986 180.9
[M]+ 303.16177142 169.7
[M]- 303.16286858 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.