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]+ 408.18056 192.8
[M+Na]+ 430.16250 195.8
[M-H]- 406.16600 199.8
[M+NH4]+ 425.20710 198.9
[M+K]+ 446.13644 195.8
[M+H-H2O]+ 390.17054 179.1
[M+HCOO]- 452.17148 203.2
[M+CH3COO]- 466.18713 200.2
[M+Na-2H]- 428.14795 192.8
[M]+ 407.17273 200.4
[M]- 407.17383 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.