CID 43597850

N-(3-aminocyclobutyl)methanesulfonamide hydrochloride

Structural Information

Molecular Formula

C₅H₁₂N₂O₂S

SMILES

CS(=O)(=O)NC1CC(C1)N

InChI

InChI=1S/C5H12N2O2S/c1-10(8,9)7-5-2-4(6)3-5/h4-5,7H,2-3,6H2,1H3

InChIKey

PCNSOMQTRPPJJV-UHFFFAOYSA-N

Compound name

N-(3-aminocyclobutyl)methanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 164.06195 Da
Monoisotopic Mass: -1.0
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]+	165.069226	131.0
[M+Na]+	187.051168	135.4
[M-H]-	163.054674	133.7
[M+NH4]+	182.095773	144.2
[M+K]+	203.025108	137.1
[M+H-H2O]+	147.059210	119.1
[M+HCOO]-	209.060151	147.9
[M+CH3COO]-	223.075801	182.2
[M+Na-2H]-	185.036616	133.9
[M]+	164.06140142	137.9
[M]-	164.06249858	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe