CID 115974

Tris(2-diethylaminoethyl)amine trihydrochloride

Structural Information

Molecular Formula
C18H42N4
SMILES
CCN(CC)CCN(CCN(CC)CC)CCN(CC)CC
InChI
InChI=1S/C18H42N4/c1-7-19(8-2)13-16-22(17-14-20(9-3)10-4)18-15-21(11-5)12-6/h7-18H2,1-6H3
InChIKey
URKRYOHZWVRTIL-UHFFFAOYSA-N
Compound name
N',N'-bis[2-(diethylamino)ethyl]-N,N-diethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

314.34094 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.34822 187.6
[M+Na]+ 337.33016 192.3
[M+NH4]+ 332.37476 193.7
[M+K]+ 353.30410 186.1
[M-H]- 313.33366 189.9
[M+Na-2H]- 335.31561 189.2
[M]+ 314.34039 188.5
[M]- 314.34149 188.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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