CID 485718

N-[[(5s)-3-[4-[[1-(2-acetamidoacetyl)-4-piperidyl]oxy]-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide

Structural Information

Molecular Formula
C21H27FN4O6
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)OC3CCN(CC3)C(=O)CNC(=O)C)F
InChI
InChI=1S/C21H27FN4O6/c1-13(27)23-10-17-12-26(21(30)32-17)15-3-4-19(18(22)9-15)31-16-5-7-25(8-6-16)20(29)11-24-14(2)28/h3-4,9,16-17H,5-8,10-12H2,1-2H3,(H,23,27)(H,24,28)/t17-/m0/s1
InChIKey
LJELBZSQFBWLOD-KRWDZBQOSA-N
Compound name
N-[[(5S)-3-[4-[1-(2-acetamidoacetyl)piperidin-4-yl]oxy-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

450.19147 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 451.19875 205.5
[M+Na]+ 473.18069 207.4
[M-H]- 449.18419 211.1
[M+NH4]+ 468.22529 210.7
[M+K]+ 489.15463 206.0
[M+H-H2O]+ 433.18873 194.6
[M+HCOO]- 495.18967 218.7
[M+CH3COO]- 509.20532 236.1
[M+Na-2H]- 471.16614 200.1
[M]+ 450.19092 203.1
[M]- 450.19202 203.1
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.