CID 75411

N,n-diethylmethanesulfonamide

Structural Information

Molecular Formula

C₅H₁₃NO₂S

SMILES

CCN(CC)S(=O)(=O)C

InChI

InChI=1S/C5H13NO2S/c1-4-6(5-2)9(3,7)8/h4-5H2,1-3H3

InChIKey

KSEMETYAQIUBQB-UHFFFAOYSA-N

Compound name

N,N-diethylmethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1397
Patents: 151.0667 Da
Monoisotopic Mass: 0.2
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]+	152.07398	132.7
[M+Na]+	174.05592	141.4
[M+NH4]+	169.10052	140.3
[M+K]+	190.02986	135.6
[M-H]-	150.05942	131.9
[M+Na-2H]-	172.04137	135.6
[M]+	151.06615	134.0
[M]-	151.06725	134.0

Literature stripe

literature stripe

Patent stripe

patents stripe