CID 58591374

729559-16-4

Structural Information

Molecular Formula

C₁₀H₁₉NOS

SMILES

CC(C)(C)S(=O)N=C1CCCCC1

InChI

InChI=1S/C10H19NOS/c1-10(2,3)13(12)11-9-7-5-4-6-8-9/h4-8H2,1-3H3

InChIKey

DELUBRHLPUTXTN-UHFFFAOYSA-N

Compound name

N-cyclohexylidene-2-methylpropane-2-sulfinamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 49
Patents: 201.11873 Da
Monoisotopic Mass: 1.6
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]+	202.12601	145.8
[M+Na]+	224.10795	150.2
[M-H]-	200.11145	149.9
[M+NH4]+	219.15255	165.8
[M+K]+	240.08189	148.8
[M+H-H2O]+	184.11599	140.0
[M+HCOO]-	246.11693	160.9
[M+CH3COO]-	260.13258	186.8
[M+Na-2H]-	222.09340	147.7
[M]+	201.11818	143.9
[M]-	201.11928	143.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe