CID 132301017

1879010-83-9

Structural Information

Molecular Formula
C22H23NO5
SMILES
COC1(CCN(CC1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O
InChI
InChI=1S/C22H23NO5/c1-27-22(20(24)25)10-12-23(13-11-22)21(26)28-14-19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,19H,10-14H2,1H3,(H,24,25)
InChIKey
CSGODWZOMIZKFV-UHFFFAOYSA-N
Compound name
1-(9H-fluoren-9-ylmethoxycarbonyl)-4-methoxypiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.15762 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.164896 190.7
[M+Na]+ 404.146838 195.8
[M-H]- 380.150344 195.7
[M+NH4]+ 399.191443 205.4
[M+K]+ 420.120778 191.9
[M+H-H2O]+ 364.154880 182.2
[M+HCOO]- 426.155821 204.5
[M+CH3COO]- 440.171471 214.9
[M+Na-2H]- 402.132286 191.4
[M]+ 381.15707142 190.9
[M]- 381.15816858 190.9
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.