CID 15369848

N,n-dimethyl-2-oxopropane-1-sulfonamide

Structural Information

Molecular Formula

C₅H₁₁NO₃S

SMILES

CC(=O)CS(=O)(=O)N(C)C

InChI

InChI=1S/C5H11NO3S/c1-5(7)4-10(8,9)6(2)3/h4H2,1-3H3

InChIKey

IROLXNFNKMCMCC-UHFFFAOYSA-N

Compound name

N,N-dimethyl-2-oxopropane-1-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 165.04596 Da
Monoisotopic Mass: -0.7
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]+	166.053236	131.2
[M+Na]+	188.035178	138.7
[M-H]-	164.038684	133.4
[M+NH4]+	183.079783	152.5
[M+K]+	204.009118	139.2
[M+H-H2O]+	148.043220	126.2
[M+HCOO]-	210.044161	149.9
[M+CH3COO]-	224.059811	180.7
[M+Na-2H]-	186.020626	134.6
[M]+	165.04541142	135.6
[M]-	165.04650858	135.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe