CID 69615604

1,2-oxazol-3-ylmethanesulfonamide

Structural Information

Molecular Formula

C₄H₆N₂O₃S

SMILES

C1=CON=C1CS(=O)(=O)N

InChI

InChI=1S/C4H6N2O3S/c5-10(7,8)3-4-1-2-9-6-4/h1-2H,3H2,(H2,5,7,8)

InChIKey

OUTFDTGUYMRODV-UHFFFAOYSA-N

Compound name

1,2-oxazol-3-ylmethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 162.00992 Da
Monoisotopic Mass: -1.1
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]+	163.01720	130.8
[M+Na]+	184.99914	139.9
[M+NH4]+	180.04374	137.6
[M+K]+	200.97308	136.9
[M-H]-	161.00264	131.4
[M+Na-2H]-	182.98459	134.3
[M]+	162.00937	132.4
[M]-	162.01047	132.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe