CID 2757965

4-cyano-1-n-fmoc-piperidine

Structural Information

Molecular Formula
C21H20N2O2
SMILES
C1CN(CCC1C#N)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C21H20N2O2/c22-13-15-9-11-23(12-10-15)21(24)25-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-8,15,20H,9-12,14H2
InChIKey
RASKRSBORLJDKF-UHFFFAOYSA-N
Compound name
9H-fluoren-9-ylmethyl 4-cyanopiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.15247 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.15975 182.6
[M+Na]+ 355.14169 191.6
[M-H]- 331.14519 186.9
[M+NH4]+ 350.18629 196.5
[M+K]+ 371.11563 181.7
[M+H-H2O]+ 315.14973 167.4
[M+HCOO]- 377.15067 195.5
[M+CH3COO]- 391.16632 190.7
[M+Na-2H]- 353.12714 183.1
[M]+ 332.15192 175.6
[M]- 332.15302 175.6
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.