CID 510272

4-[(5s)-5-(acetamidomethyl)-2-oxo-oxazolidin-3-yl]-2-fluoro-benzamide

Structural Information

Molecular Formula
C13H14FN3O4
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)C(=O)N)F
InChI
InChI=1S/C13H14FN3O4/c1-7(18)16-5-9-6-17(13(20)21-9)8-2-3-10(12(15)19)11(14)4-8/h2-4,9H,5-6H2,1H3,(H2,15,19)(H,16,18)/t9-/m0/s1
InChIKey
QPPQJVDJANJELR-VIFPVBQESA-N
Compound name
4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

295.09683 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.10411 165.4
[M+Na]+ 318.08605 172.3
[M-H]- 294.08955 170.2
[M+NH4]+ 313.13065 178.9
[M+K]+ 334.05999 170.6
[M+H-H2O]+ 278.09409 156.8
[M+HCOO]- 340.09503 185.5
[M+CH3COO]- 354.11068 206.7
[M+Na-2H]- 316.07150 164.6
[M]+ 295.09628 163.5
[M]- 295.09738 163.5
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

patents stripe