CID 476963

Schembl8406407

Structural Information

Molecular Formula
C14H13FN4O4
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)C3=NOC=N3)F
InChI
InChI=1S/C14H13FN4O4/c1-8(20)16-5-10-6-19(14(21)23-10)9-2-3-11(12(15)4-9)13-17-7-22-18-13/h2-4,7,10H,5-6H2,1H3,(H,16,20)/t10-/m0/s1
InChIKey
FJURXHZTJDDRFQ-JTQLQIEISA-N
Compound name
N-[[(5S)-3-[3-fluoro-4-(1,2,4-oxadiazol-3-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

320.09207 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.09935 170.3
[M+Na]+ 343.08129 178.7
[M-H]- 319.08479 177.2
[M+NH4]+ 338.12589 180.8
[M+K]+ 359.05523 177.4
[M+H-H2O]+ 303.08933 160.6
[M+HCOO]- 365.09027 188.9
[M+CH3COO]- 379.10592 206.6
[M+Na-2H]- 341.06674 170.2
[M]+ 320.09152 171.8
[M]- 320.09262 171.8
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