CID 62475080

1628734-96-2

Structural Information

Molecular Formula

C₅H₁₁NO₂S

SMILES

CS(=O)(=O)C1(CC1)CN

InChI

InChI=1S/C5H11NO2S/c1-9(7,8)5(4-6)2-3-5/h2-4,6H2,1H3

InChIKey

TZIMDZUAEJJJRT-UHFFFAOYSA-N

Compound name

(1-methylsulfonylcyclopropyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 66
Patents: 149.05106 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]+	150.05834	134.6
[M+Na]+	172.04028	144.8
[M+NH4]+	167.08488	144.2
[M+K]+	188.01422	138.7
[M-H]-	148.04378	141.7
[M+Na-2H]-	170.02573	142.3
[M]+	149.05051	139.6
[M]-	149.05161	139.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe