CID 16787497

1173069-26-5

Structural Information

Molecular Formula

C₅H₁₂N₂O₂S

SMILES

C1CC1NS(=O)(=O)CCN

InChI

InChI=1S/C5H12N2O2S/c6-3-4-10(8,9)7-5-1-2-5/h5,7H,1-4,6H2

InChIKey

OCBRNYFPRWGYMS-UHFFFAOYSA-N

Compound name

2-amino-N-cyclopropylethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 164.06195 Da
Monoisotopic Mass: -0.5
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]+	165.06923	128.4
[M+Na]+	187.05117	136.7
[M-H]-	163.05467	132.5
[M+NH4]+	182.09577	143.7
[M+K]+	203.02511	133.3
[M+H-H2O]+	147.05921	122.4
[M+HCOO]-	209.06015	148.0
[M+CH3COO]-	223.07580	181.5
[M+Na-2H]-	185.03662	133.6
[M]+	164.06140	130.9
[M]-	164.06250	130.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe