CID 43178897

N-[2-(morpholin-4-yl)ethyl]thiolan-3-amine dihydrochloride

Structural Information

Molecular Formula

C₁₀H₂₀N₂OS

SMILES

C1CSCC1NCCN2CCOCC2

InChI

InChI=1S/C10H20N2OS/c1-8-14-9-10(1)11-2-3-12-4-6-13-7-5-12/h10-11H,1-9H2

InChIKey

LOXHIXLOWSARCA-UHFFFAOYSA-N

Compound name

N-(2-morpholin-4-ylethyl)thiolan-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 216.12964 Da
Monoisotopic Mass: 0.3
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]+	217.136916	148.4
[M+Na]+	239.118858	151.3
[M-H]-	215.122364	152.8
[M+NH4]+	234.163463	165.8
[M+K]+	255.092798	150.3
[M+H-H2O]+	199.126900	141.1
[M+HCOO]-	261.127841	161.9
[M+CH3COO]-	275.143491	185.0
[M+Na-2H]-	237.104306	149.3
[M]+	216.12909142	143.9
[M]-	216.13018858	143.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.