CID 3088080

116943-62-5

Structural Information

Molecular Formula

C₁₀H₁₂N₂O₄S

SMILES

C1COC(=O)N1S(=O)(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C10H12N2O4S/c13-10-12(6-7-16-10)17(14,15)11-8-9-4-2-1-3-5-9/h1-5,11H,6-8H2

InChIKey

YEDSLTQWBIGQOB-UHFFFAOYSA-N

Compound name

N-benzyl-2-oxo-1,3-oxazolidine-3-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 256.0518 Da
Monoisotopic Mass: 1.2
XlogP (predicted)

Profile

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]+	257.059076	153.5
[M+Na]+	279.041018	161.1
[M-H]-	255.044524	159.8
[M+NH4]+	274.085623	169.5
[M+K]+	295.014958	159.4
[M+H-H2O]+	239.049060	146.9
[M+HCOO]-	301.050001	170.9
[M+CH3COO]-	315.065651	189.4
[M+Na-2H]-	277.026466	157.9
[M]+	256.05125142	155.3
[M]-	256.05234858	155.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe