CID 3077310

134070-15-8

Structural Information

Molecular Formula
C26H32F2N2O3
SMILES
CCN1C(=O)OC2(C1(C)O)CCN(CC2)CCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F
InChI
InChI=1S/C26H32F2N2O3/c1-3-30-24(31)33-26(25(30,2)32)14-17-29(18-15-26)16-4-5-23(19-6-10-21(27)11-7-19)20-8-12-22(28)13-9-20/h6-13,23,32H,3-5,14-18H2,1-2H3
InChIKey
WXDPRSXQNQULBA-UHFFFAOYSA-N
Compound name
8-[4,4-bis(4-fluorophenyl)butyl]-3-ethyl-4-hydroxy-4-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

458.2381 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 459.24538 215.1
[M+Na]+ 481.22732 224.9
[M+NH4]+ 476.27192 222.0
[M+K]+ 497.20126 216.1
[M-H]- 457.23082 217.8
[M+Na-2H]- 479.21277 220.5
[M]+ 458.23755 217.3
[M]- 458.23865 217.3
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.