CID 75422286

1-methanesulfonyl-2-methylpropan-2-amine hydrochloride

Structural Information

Molecular Formula

C₅H₁₃NO₂S

SMILES

CC(C)(CS(=O)(=O)C)N

InChI

InChI=1S/C5H13NO2S/c1-5(2,6)4-9(3,7)8/h4,6H2,1-3H3

InChIKey

OVNBCUGVWGAILZ-UHFFFAOYSA-N

Compound name

2-methyl-1-methylsulfonylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 43
Patents: 151.0667 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]+	152.07398	130.6
[M+Na]+	174.05592	138.5
[M-H]-	150.05942	130.9
[M+NH4]+	169.10052	151.9
[M+K]+	190.02986	137.2
[M+H-H2O]+	134.06396	126.4
[M+HCOO]-	196.06490	147.3
[M+CH3COO]-	210.08055	175.0
[M+Na-2H]-	172.04137	135.3
[M]+	151.06615	132.0
[M]-	151.06725	132.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe