CID 476967

Schembl8403941

Structural Information

Molecular Formula
C15H14FN5O5
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)C3=NOC(=N3)C(=O)N)F
InChI
InChI=1S/C15H14FN5O5/c1-7(22)18-5-9-6-21(15(24)25-9)8-2-3-10(11(16)4-8)13-19-14(12(17)23)26-20-13/h2-4,9H,5-6H2,1H3,(H2,17,23)(H,18,22)/t9-/m0/s1
InChIKey
IZIDTEZPUITQPN-VIFPVBQESA-N
Compound name
3-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-1,2,4-oxadiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

363.0979 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.10518 181.6
[M+Na]+ 386.08712 189.1
[M-H]- 362.09062 188.6
[M+NH4]+ 381.13172 189.7
[M+K]+ 402.06106 188.0
[M+H-H2O]+ 346.09516 171.8
[M+HCOO]- 408.09610 199.7
[M+CH3COO]- 422.11175 218.5
[M+Na-2H]- 384.07257 179.3
[M]+ 363.09735 182.4
[M]- 363.09845 182.4
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

patents stripe