CID 52303

Ethylenediamine, n,n'-diethylthiomethyl-n,n'-dimethyl-, dihydrochloride

Structural Information

Molecular Formula
C10H24N2S2
SMILES
CCSCN(C)CCN(C)CSCC
InChI
InChI=1S/C10H24N2S2/c1-5-13-9-11(3)7-8-12(4)10-14-6-2/h5-10H2,1-4H3
InChIKey
DJXCETCOBMVDSE-UHFFFAOYSA-N
Compound name
N,N'-bis(ethylsulfanylmethyl)-N,N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.13809 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.14537 154.4
[M+Na]+ 259.12731 158.1
[M-H]- 235.13081 156.2
[M+NH4]+ 254.17191 173.3
[M+K]+ 275.10125 156.5
[M+H-H2O]+ 219.13535 146.8
[M+HCOO]- 281.13629 167.7
[M+CH3COO]- 295.15194 204.2
[M+Na-2H]- 257.11276 152.9
[M]+ 236.13754 160.4
[M]- 236.13864 160.4
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.