CID 3063607

2-(morpholinoamino)ethanethiol

Structural Information

Molecular Formula

C₆H₁₄N₂OS

SMILES

C1COCCN1NCCS

InChI

InChI=1S/C6H14N2OS/c10-6-1-7-8-2-4-9-5-3-8/h7,10H,1-6H2

InChIKey

NUCCXOFTUGVRMW-UHFFFAOYSA-N

Compound name

2-(morpholin-4-ylamino)ethanethiol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 162.08269 Da
Monoisotopic Mass: -0.1
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]+	163.08997	133.6
[M+Na]+	185.07191	143.2
[M+NH4]+	180.11651	142.4
[M+K]+	201.04585	135.9
[M-H]-	161.07541	136.9
[M+Na-2H]-	183.05736	137.8
[M]+	162.08214	136.2
[M]-	162.08324	136.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.