CID 134540204

2375273-95-1

Structural Information

Molecular Formula

C₆H₁₂N₂O₂S

SMILES

C1CC1NS(=O)(=O)C2CNC2

InChI

InChI=1S/C6H12N2O2S/c9-11(10,6-3-7-4-6)8-5-1-2-5/h5-8H,1-4H2

InChIKey

FSEVGOWEKXWABQ-UHFFFAOYSA-N

Compound name

N-cyclopropylazetidine-3-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 176.06195 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]+	177.069226	130.7
[M+Na]+	199.051168	136.5
[M-H]-	175.054674	134.8
[M+NH4]+	194.095773	137.7
[M+K]+	215.025108	136.2
[M+H-H2O]+	159.059210	118.5
[M+HCOO]-	221.060151	145.5
[M+CH3COO]-	235.075801	181.9
[M+Na-2H]-	197.036616	135.1
[M]+	176.06140142	139.1
[M]-	176.06249858	139.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe