CID 476959

Pnu 179004

Structural Information

Molecular Formula
C15H14FN3O4
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)C3=CC=NO3)F
InChI
InChI=1S/C15H14FN3O4/c1-9(20)17-7-11-8-19(15(21)22-11)10-2-3-12(13(16)6-10)14-4-5-18-23-14/h2-6,11H,7-8H2,1H3,(H,17,20)/t11-/m0/s1
InChIKey
IYJPTJXPJVTGRN-NSHDSACASA-N
Compound name
N-[[(5S)-3-[3-fluoro-4-(1,2-oxazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.09683 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.10411 170.6
[M+Na]+ 342.08605 178.7
[M-H]- 318.08955 178.7
[M+NH4]+ 337.13065 182.6
[M+K]+ 358.05999 177.4
[M+H-H2O]+ 302.09409 161.8
[M+HCOO]- 364.09503 190.3
[M+CH3COO]- 378.11068 206.7
[M+Na-2H]- 340.07150 170.4
[M]+ 319.09628 172.0
[M]- 319.09738 172.0
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.