PubChemLite - N-[[(5s)-3-[6-[[1-(2-benzyloxyacetyl)-4-piperidyl]oxy]-3-pyridyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide (C25H30N4O6)

Structural Information

Molecular Formula

SMILES

CC(=O)NC[C@H]1CN(C(=O)O1)C2=CN=C(C=C2)OC3CCN(CC3)C(=O)COCC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O6/c1-18(30)26-14-22-15-29(25(32)35-22)20-7-8-23(27-13-20)34-21-9-11-28(12-10-21)24(31)17-33-16-19-5-3-2-4-6-19/h2-8,13,21-22H,9-12,14-17H2,1H3,(H,26,30)/t22-/m0/s1

InChIKey

SQIBGNHMVUAHPC-QFIPXVFZSA-N

Compound name

N-[[(5S)-2-oxo-3-[6-[1-(2-phenylmethoxyacetyl)piperidin-4-yl]oxypyridin-3-yl]-1,3-oxazolidin-5-yl]methyl]acetamide

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	483.22380	213.7
[M+Na]+	505.20574	214.5
[M-H]-	481.20924	221.6
[M+NH4]+	500.25034	215.4
[M+K]+	521.17968	212.2
[M+H-H2O]+	465.21378	200.8
[M+HCOO]-	527.21472	226.0
[M+CH3COO]-	541.23037	237.6
[M+Na-2H]-	503.19119	209.8
[M]+	482.21597	212.7
[M]-	482.21707	212.7

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

483.22380

213.7

[M+Na]+

505.20574

214.5

[M-H]-

481.20924

221.6

[M+NH4]+

500.25034

215.4

[M+K]+

521.17968

212.2

[M+H-H2O]+

465.21378

200.8

[M+HCOO]-

527.21472

226.0

[M+CH3COO]-

541.23037

237.6

[M+Na-2H]-

503.19119

209.8

[M]+

482.21597

212.7

[M]-

482.21707

212.7

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

N-[[(5s)-3-[6-[[1-(2-benzyloxyacetyl)-4-piperidyl]oxy]-3-pyridyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

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