CID 3032813

Oxamide, n,n'-bis(2-methoxyethyl)dithio-

Structural Information

Molecular Formula

C₈H₁₆N₂O₂S₂

SMILES

COCCNC(=S)C(=S)NCCOC

InChI

InChI=1S/C8H16N2O2S2/c1-11-5-3-9-7(13)8(14)10-4-6-12-2/h3-6H2,1-2H3,(H,9,13)(H,10,14)

InChIKey

OQNFYFONNMFOPH-UHFFFAOYSA-N

Compound name

N,N'-bis(2-methoxyethyl)ethanedithioamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 236.06532 Da
Monoisotopic Mass: 0.2
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]+	237.072596	151.6
[M+Na]+	259.054538	155.7
[M-H]-	235.058044	150.7
[M+NH4]+	254.099143	168.9
[M+K]+	275.028478	152.2
[M+H-H2O]+	219.062580	144.7
[M+HCOO]-	281.063521	163.5
[M+CH3COO]-	295.079171	193.2
[M+Na-2H]-	257.039986	150.6
[M]+	236.06477142	154.2
[M]-	236.06586858	154.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe