CID 6482308

(s)-n-[[3-(3-fluoro-4-morpholinylphenyl)-2-oxo-5-oxazolidinyl]methyl]-4-(2-naphthyl)-4-oxobutanamide

Structural Information

Molecular Formula
C28H28FN3O5
SMILES
C1COCCN1C2=C(C=C(C=C2)N3C[C@@H](OC3=O)CNC(=O)CCC(=O)C4=CC5=CC=CC=C5C=C4)F
InChI
InChI=1S/C28H28FN3O5/c29-24-16-22(7-8-25(24)31-11-13-36-14-12-31)32-18-23(37-28(32)35)17-30-27(34)10-9-26(33)21-6-5-19-3-1-2-4-20(19)15-21/h1-8,15-16,23H,9-14,17-18H2,(H,30,34)/t23-/m0/s1
InChIKey
DTEJAUFQHTYBCK-QHCPKHFHSA-N
Compound name
N-[[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-naphthalen-2-yl-4-oxobutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

505.2013 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 506.20858 222.1
[M+Na]+ 528.19052 224.4
[M-H]- 504.19402 231.4
[M+NH4]+ 523.23512 223.9
[M+K]+ 544.16446 220.9
[M+H-H2O]+ 488.19856 209.0
[M+HCOO]- 550.19950 232.0
[M+CH3COO]- 564.21515 227.3
[M+Na-2H]- 526.17597 217.8
[M]+ 505.20075 219.1
[M]- 505.20185 219.1
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.