CID 6482304

(s)-n-[[3-(3-fluoro-4-thiomorpholinylphenyl)-2-oxo-5-oxazolidinyl]methyl]-4-oxo-4-phenylbutanamide

Structural Information

Molecular Formula
C24H26FN3O4S
SMILES
C1CSCCN1C2=C(C=C(C=C2)N3C[C@@H](OC3=O)CNC(=O)CCC(=O)C4=CC=CC=C4)F
InChI
InChI=1S/C24H26FN3O4S/c25-20-14-18(6-7-21(20)27-10-12-33-13-11-27)28-16-19(32-24(28)31)15-26-23(30)9-8-22(29)17-4-2-1-3-5-17/h1-7,14,19H,8-13,15-16H2,(H,26,30)/t19-/m0/s1
InChIKey
REJIAARMKPXSQK-IBGZPJMESA-N
Compound name
N-[[(5S)-3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-oxo-4-phenylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

471.1628 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 472.17008 211.1
[M+Na]+ 494.15202 213.7
[M-H]- 470.15552 219.1
[M+NH4]+ 489.19662 215.9
[M+K]+ 510.12596 209.0
[M+H-H2O]+ 454.16006 199.8
[M+HCOO]- 516.16100 219.5
[M+CH3COO]- 530.17665 234.0
[M+Na-2H]- 492.13747 205.2
[M]+ 471.16225 208.4
[M]- 471.16335 208.4
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.