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]+ 392.18562 197.1
[M+Na]+ 414.16756 202.1
[M-H]- 390.17106 205.1
[M+NH4]+ 409.21216 215.3
[M+K]+ 430.14150 197.0
[M+H-H2O]+ 374.17560 190.4
[M+HCOO]- 436.17654 211.7
[M+CH3COO]- 450.19219 205.9
[M+Na-2H]- 412.15301 192.3
[M]+ 391.17779 195.2
[M]- 391.17889 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.