CID 56777035

Fmoc-4-piperidino-l-proline

Structural Information

Molecular Formula
C25H28N2O3
SMILES
C1C[C@H](N(C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)C5CCNCC5
InChI
InChI=1S/C25H28N2O3/c28-24(17-11-13-26-14-12-17)23-10-5-15-27(23)25(29)30-16-22-20-8-3-1-6-18(20)19-7-2-4-9-21(19)22/h1-4,6-9,17,22-23,26H,5,10-16H2/t23-/m0/s1
InChIKey
SYTHXYZVTLCILY-QHCPKHFHSA-N
Compound name
9H-fluoren-9-ylmethyl (2S)-2-(piperidine-4-carbonyl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

404.21 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.21728 199.5
[M+Na]+ 427.19922 209.4
[M+NH4]+ 422.24382 206.7
[M+K]+ 443.17316 206.1
[M-H]- 403.20272 203.3
[M+Na-2H]- 425.18467 202.7
[M]+ 404.20945 201.6
[M]- 404.21055 201.6
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.