CID 28063369

4-(4-piperidinyl)thiomorpholine dihydrochloride

Structural Information

Molecular Formula

C₉H₁₈N₂S

SMILES

C1CNCCC1N2CCSCC2

InChI

InChI=1S/C9H18N2S/c1-3-10-4-2-9(1)11-5-7-12-8-6-11/h9-10H,1-8H2

InChIKey

SBNUKGVQXYBWLO-UHFFFAOYSA-N

Compound name

4-piperidin-4-ylthiomorpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 62
Patents: 186.11906 Da
Monoisotopic Mass: 0.8
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]+	187.126336	141.8
[M+Na]+	209.108278	144.4
[M-H]-	185.111784	142.4
[M+NH4]+	204.152883	157.9
[M+K]+	225.082218	141.2
[M+H-H2O]+	169.116320	134.0
[M+HCOO]-	231.117261	150.1
[M+CH3COO]-	245.132911	151.1
[M+Na-2H]-	207.093726	142.8
[M]+	186.11851142	132.1
[M]-	186.11960858	132.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe