CID 119056976

(2-aminoethyl)(methyl)(methylimino)-lambda6-sulfanone

Structural Information

Molecular Formula

C₄H₁₂N₂OS

SMILES

CN=S(=O)(C)CCN

InChI

InChI=1S/C4H12N2OS/c1-6-8(2,7)4-3-5/h3-5H2,1-2H3

InChIKey

COUXYPTWCPNSJX-UHFFFAOYSA-N

Compound name

2-(N,S-dimethylsulfonimidoyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 136.06703 Da
Monoisotopic Mass: -0.6
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]+	137.07431	126.2
[M+Na]+	159.05625	133.9
[M-H]-	135.05975	127.8
[M+NH4]+	154.10085	148.5
[M+K]+	175.03019	132.8
[M+H-H2O]+	119.06429	121.0
[M+HCOO]-	181.06523	146.9
[M+CH3COO]-	195.08088	176.4
[M+Na-2H]-	157.04170	131.2
[M]+	136.06648	127.3
[M]-	136.06758	127.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe