CID 10519785

168828-84-0

Structural Information

Molecular Formula
C14H16FN5O3
SMILES
C1COCCN1C2=C(C=C(C=C2)N3C[C@@H](OC3=O)CN=[N+]=[N-])F
InChI
InChI=1S/C14H16FN5O3/c15-12-7-10(1-2-13(12)19-3-5-22-6-4-19)20-9-11(8-17-18-16)23-14(20)21/h1-2,7,11H,3-6,8-9H2/t11-/m0/s1
InChIKey
FQUBFDDPWLBKIZ-NSHDSACASA-N
Compound name
(5R)-5-(azidomethyl)-3-(3-fluoro-4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

71
Patents

321.12372 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.13100 174.4
[M+Na]+ 344.11294 178.9
[M-H]- 320.11644 183.3
[M+NH4]+ 339.15754 184.3
[M+K]+ 360.08688 172.8
[M+H-H2O]+ 304.12098 167.4
[M+HCOO]- 366.12192 195.3
[M+CH3COO]- 380.13757 208.3
[M+Na-2H]- 342.09839 179.7
[M]+ 321.12317 168.4
[M]- 321.12427 168.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe