CID 154577523

2418705-77-6

Structural Information

Molecular Formula
C22H24N2O2
SMILES
C1C2CNCC1CN(C2)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35
InChI
InChI=1S/C22H24N2O2/c25-22(24-12-15-9-16(13-24)11-23-10-15)26-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-8,15-16,21,23H,9-14H2
InChIKey
PXLHEKMQZDNAAC-UHFFFAOYSA-N
Compound name
9H-fluoren-9-ylmethyl 3,7-diazabicyclo[3.3.1]nonane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.18378 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.19106 185.5
[M+Na]+ 371.17300 197.9
[M+NH4]+ 366.21760 194.7
[M+K]+ 387.14694 191.0
[M-H]- 347.17650 188.7
[M+Na-2H]- 369.15845 188.1
[M]+ 348.18323 188.1
[M]- 348.18433 188.1
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.