CID 132350937

2138374-29-3

Structural Information

Molecular Formula
C22H23NO5
SMILES
C1CN(CCC1C(C(=O)O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C22H23NO5/c24-20(21(25)26)14-9-11-23(12-10-14)22(27)28-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,14,19-20,24H,9-13H2,(H,25,26)
InChIKey
PENZOPQDRUIPBT-UHFFFAOYSA-N
Compound name
2-[1-(9H-fluoren-9-ylmethoxycarbonyl)piperidin-4-yl]-2-hydroxyacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.15762 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.16490 189.0
[M+Na]+ 404.14684 192.1
[M-H]- 380.15034 192.3
[M+NH4]+ 399.19144 200.8
[M+K]+ 420.12078 188.0
[M+H-H2O]+ 364.15488 180.9
[M+HCOO]- 426.15582 200.2
[M+CH3COO]- 440.17147 214.2
[M+Na-2H]- 402.13229 187.2
[M]+ 381.15707 186.5
[M]- 381.15817 186.5
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.