CID 16226707

863669-68-5

Structural Information

Molecular Formula
C10H22N2O2S
SMILES
CCN(CC)CCNC1CCS(=O)(=O)C1
InChI
InChI=1S/C10H22N2O2S/c1-3-12(4-2)7-6-11-10-5-8-15(13,14)9-10/h10-11H,3-9H2,1-2H3
InChIKey
JDGBZZMJOOCQCG-UHFFFAOYSA-N
Compound name
N-(1,1-dioxothiolan-3-yl)-N',N'-diethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.1402 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.14748 154.2
[M+Na]+ 257.12942 160.5
[M+NH4]+ 252.17402 162.9
[M+K]+ 273.10336 153.5
[M-H]- 233.13292 155.5
[M+Na-2H]- 255.11487 158.1
[M]+ 234.13965 155.6
[M]- 234.14075 155.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.