CID 62734622

N-cyclopropyl-2-methoxyethane-1-sulfonamide

Structural Information

Molecular Formula

C₆H₁₃NO₃S

SMILES

COCCS(=O)(=O)NC1CC1

InChI

InChI=1S/C6H13NO3S/c1-10-4-5-11(8,9)7-6-2-3-6/h6-7H,2-5H2,1H3

InChIKey

AUPIPLDWEQXKLC-UHFFFAOYSA-N

Compound name

N-cyclopropyl-2-methoxyethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 179.06161 Da
Monoisotopic Mass: -0.3
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]+	180.068886	134.6
[M+Na]+	202.050828	143.2
[M-H]-	178.054334	139.2
[M+NH4]+	197.095433	149.9
[M+K]+	218.024768	140.7
[M+H-H2O]+	162.058870	128.6
[M+HCOO]-	224.059811	153.8
[M+CH3COO]-	238.075461	182.2
[M+Na-2H]-	200.036276	139.9
[M]+	179.06106142	140.5
[M]-	179.06215858	140.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.