CID 17793884

100173-92-0

Structural Information

Molecular Formula
C20H45N3
SMILES
CCCCN(CCCC)CCNCCN(CCCC)CCCC
InChI
InChI=1S/C20H45N3/c1-5-9-15-22(16-10-6-2)19-13-21-14-20-23(17-11-7-3)18-12-8-4/h21H,5-20H2,1-4H3
InChIKey
LLHVBJQIWZHCCV-UHFFFAOYSA-N
Compound name
N',N'-dibutyl-N-[2-(dibutylamino)ethyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

327.36136 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.36864 192.0
[M+Na]+ 350.35058 197.2
[M+NH4]+ 345.39518 197.9
[M+K]+ 366.32452 189.1
[M-H]- 326.35408 193.3
[M+Na-2H]- 348.33603 192.9
[M]+ 327.36081 192.7
[M]- 327.36191 192.7
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

patents stripe