CID 137949465

2171973-33-2

Structural Information

Molecular Formula
C24H25NO4
SMILES
C1CCC2(C1)CN(CC2C(=O)O)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35
InChI
InChI=1S/C24H25NO4/c26-22(27)21-13-25(15-24(21)11-5-6-12-24)23(28)29-14-20-18-9-3-1-7-16(18)17-8-2-4-10-19(17)20/h1-4,7-10,20-21H,5-6,11-15H2,(H,26,27)
InChIKey
UQCIWGDENMGQEW-UHFFFAOYSA-N
Compound name
2-(9H-fluoren-9-ylmethoxycarbonyl)-2-azaspiro[4.4]nonane-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

391.17834 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.185616 197.1
[M+Na]+ 414.167558 202.1
[M-H]- 390.171064 205.1
[M+NH4]+ 409.212163 215.3
[M+K]+ 430.141498 197.0
[M+H-H2O]+ 374.175600 190.4
[M+HCOO]- 436.176541 211.7
[M+CH3COO]- 450.192191 205.9
[M+Na-2H]- 412.153006 192.3
[M]+ 391.17779142 195.2
[M]- 391.17888858 195.2
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.