CID 1502083

9h-fluoren-9-ylmethyl 4-hydroxypiperidine-1-carboxylate

Structural Information

Molecular Formula

C₂₀H₂₁NO₃

SMILES

C1CN(CCC1O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C20H21NO3/c22-14-9-11-21(12-10-14)20(23)24-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,14,19,22H,9-13H2

InChIKey

DANUFRHHXWZNIK-UHFFFAOYSA-N

Compound name

9H-fluoren-9-ylmethyl 4-hydroxypiperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 49
Patents: 323.15213 Da
Monoisotopic Mass: 3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	324.159406	176.3
[M+Na]+	346.141348	181.8
[M-H]-	322.144854	181.3
[M+NH4]+	341.185953	191.8
[M+K]+	362.115288	176.6
[M+H-H2O]+	306.149390	167.9
[M+HCOO]-	368.150331	191.4
[M+CH3COO]-	382.165981	185.8
[M+Na-2H]-	344.126796	177.6
[M]+	323.15158142	173.9
[M]-	323.15267858	173.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe