CID 496993

Ranbezolid hydrochloride

Structural Information

Molecular Formula
C21H24FN5O6
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=C(O4)[N+](=O)[O-])F
InChI
InChI=1S/C21H24FN5O6/c1-14(28)23-11-17-13-26(21(29)33-17)15-2-4-19(18(22)10-15)25-8-6-24(7-9-25)12-16-3-5-20(32-16)27(30)31/h2-5,10,17H,6-9,11-13H2,1H3,(H,23,28)/t17-/m0/s1
InChIKey
PWHNTOQANLCTHN-KRWDZBQOSA-N
Compound name
N-[[(5S)-3-[3-fluoro-4-[4-[(5-nitrofuran-2-yl)methyl]piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

16
References

726
Patents

461.17105 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 462.17833 205.0
[M+Na]+ 484.16027 213.5
[M+NH4]+ 479.20487 207.4
[M+K]+ 500.13421 216.9
[M-H]- 460.16377 210.5
[M+Na-2H]- 482.14572 206.7
[M]+ 461.17050 207.0
[M]- 461.17160 207.0
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