CID 21978

Brn 2254144

Structural Information

Molecular Formula
C14H32N2S4
SMILES
CCSCN(CCN(CSCC)CSCC)CSCC
InChI
InChI=1S/C14H32N2S4/c1-5-17-11-15(12-18-6-2)9-10-16(13-19-7-3)14-20-8-4/h5-14H2,1-4H3
InChIKey
LSXGXRPEJWRESX-UHFFFAOYSA-N
Compound name
N,N,N',N'-tetrakis(ethylsulfanylmethyl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.14484 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.152116 178.0
[M+Na]+ 379.134058 179.2
[M-H]- 355.137564 176.3
[M+NH4]+ 374.178663 190.6
[M+K]+ 395.107998 171.2
[M+H-H2O]+ 339.142100 168.6
[M+HCOO]- 401.143041 176.8
[M+CH3COO]- 415.158691 224.9
[M+Na-2H]- 377.119506 174.4
[M]+ 356.14429142 181.3
[M]- 356.14538858 181.3
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.