CID 69564148

2-cyclobutylethane-1-sulfonamide

Structural Information

Molecular Formula

C₆H₁₃NO₂S

SMILES

C1CC(C1)CCS(=O)(=O)N

InChI

InChI=1S/C6H13NO2S/c7-10(8,9)5-4-6-2-1-3-6/h6H,1-5H2,(H2,7,8,9)

InChIKey

KUVHCGFPGRCUNU-UHFFFAOYSA-N

Compound name

2-cyclobutylethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 163.0667 Da
Monoisotopic Mass: 0.9
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]+	164.073976	130.3
[M+Na]+	186.055918	134.7
[M-H]-	162.059424	132.8
[M+NH4]+	181.100523	143.9
[M+K]+	202.029858	136.1
[M+H-H2O]+	146.063960	119.0
[M+HCOO]-	208.064901	146.2
[M+CH3COO]-	222.080551	179.2
[M+Na-2H]-	184.041366	133.3
[M]+	163.06615142	138.1
[M]-	163.06724858	138.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe