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]+ 382.16490 190.7
[M+Na]+ 404.14684 195.8
[M-H]- 380.15034 195.7
[M+NH4]+ 399.19144 205.4
[M+K]+ 420.12078 191.9
[M+H-H2O]+ 364.15488 182.2
[M+HCOO]- 426.15582 204.5
[M+CH3COO]- 440.17147 214.9
[M+Na-2H]- 402.13229 191.4
[M]+ 381.15707 190.9
[M]- 381.15817 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.