CID 137928707

2260936-93-2

Structural Information

Molecular Formula
C24H25NO5
SMILES
C1CC2(C1)COC(CN2C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)CC(=O)O
InChI
InChI=1S/C24H25NO5/c26-22(27)12-16-13-25(24(15-30-16)10-5-11-24)23(28)29-14-21-19-8-3-1-6-17(19)18-7-2-4-9-20(18)21/h1-4,6-9,16,21H,5,10-15H2,(H,26,27)
InChIKey
ZNUSVGZJDXTDMI-UHFFFAOYSA-N
Compound name
2-[5-(9H-fluoren-9-ylmethoxycarbonyl)-8-oxa-5-azaspiro[3.5]nonan-7-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

407.17328 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 408.180556 192.8
[M+Na]+ 430.162498 195.8
[M-H]- 406.166004 199.8
[M+NH4]+ 425.207103 198.9
[M+K]+ 446.136438 195.8
[M+H-H2O]+ 390.170540 179.1
[M+HCOO]- 452.171481 203.2
[M+CH3COO]- 466.187131 200.2
[M+Na-2H]- 428.147946 192.8
[M]+ 407.17273142 200.4
[M]- 407.17382858 200.4
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.