CID 72942464

1373512-21-0

Structural Information

Molecular Formula
C20H21NO3
SMILES
C1C[C@@H](CN(C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)O
InChI
InChI=1S/C20H21NO3/c22-14-6-5-11-21(12-14)20(23)24-13-19-17-9-3-1-7-15(17)16-8-2-4-10-18(16)19/h1-4,7-10,14,19,22H,5-6,11-13H2/t14-/m0/s1
InChIKey
UPMBUSIITKEKOM-AWEZNQCLSA-N
Compound name
9H-fluoren-9-ylmethyl (3S)-3-hydroxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.15213 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.15941 176.3
[M+Na]+ 346.14135 181.8
[M-H]- 322.14485 181.3
[M+NH4]+ 341.18595 191.8
[M+K]+ 362.11529 176.6
[M+H-H2O]+ 306.14939 167.9
[M+HCOO]- 368.15033 191.4
[M+CH3COO]- 382.16598 185.8
[M+Na-2H]- 344.12680 177.6
[M]+ 323.15158 173.9
[M]- 323.15268 173.9
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.