CID 58365

Ethylenediamine, n,n,n',n'-tetrakis(2-chloropropyl)-, dihydrochloride

Structural Information

Molecular Formula
C14H28Cl4N2
SMILES
CC(CN(CCN(CC(C)Cl)CC(C)Cl)CC(C)Cl)Cl
InChI
InChI=1S/C14H28Cl4N2/c1-11(15)7-19(8-12(2)16)5-6-20(9-13(3)17)10-14(4)18/h11-14H,5-10H2,1-4H3
InChIKey
UYVWQIKJVLNSGW-UHFFFAOYSA-N
Compound name
N,N,N',N'-tetrakis(2-chloropropyl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.10065 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.107926 186.5
[M+Na]+ 387.089868 189.3
[M-H]- 363.093374 185.3
[M+NH4]+ 382.134473 200.6
[M+K]+ 403.063808 185.3
[M+H-H2O]+ 347.097910 183.1
[M+HCOO]- 409.098851 187.0
[M+CH3COO]- 423.114501 227.8
[M+Na-2H]- 385.075316 180.3
[M]+ 364.10010142 191.3
[M]- 364.10119858 191.3
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.