CID 7648

4,4'-dithiodimorpholine

Structural Information

Molecular Formula

C₈H₁₆N₂O₂S₂

SMILES

C1COCCN1SSN2CCOCC2

InChI

InChI=1S/C8H16N2O2S2/c1-5-11-6-2-9(1)13-14-10-3-7-12-8-4-10/h1-8H2

InChIKey

HLBZWYXLQJQBKU-UHFFFAOYSA-N

Compound name

4-(morpholin-4-yldisulfanyl)morpholine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 13
References: 12521
Patents: 236.06532 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]+	237.07260	147.0
[M+Na]+	259.05454	156.7
[M+NH4]+	254.09914	155.7
[M+K]+	275.02848	148.0
[M-H]-	235.05804	152.3
[M+Na-2H]-	257.03999	150.3
[M]+	236.06477	150.7
[M]-	236.06587	150.7

Literature stripe

literature stripe

Patent stripe

patents stripe