CID 79478

N,n-bis(2-diethylaminoethyl)aniline

Structural Information

Molecular Formula
C18H33N3
SMILES
CCN(CC)CCN(CCN(CC)CC)C1=CC=CC=C1
InChI
InChI=1S/C18H33N3/c1-5-19(6-2)14-16-21(17-15-20(7-3)8-4)18-12-10-9-11-13-18/h9-13H,5-8,14-17H2,1-4H3
InChIKey
FPVVUDMZUOYOEU-UHFFFAOYSA-N
Compound name
N'-[2-(diethylamino)ethyl]-N,N-diethyl-N'-phenylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

291.26746 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.27474 177.4
[M+Na]+ 314.25668 186.2
[M+NH4]+ 309.30128 185.2
[M+K]+ 330.23062 178.6
[M-H]- 290.26018 182.1
[M+Na-2H]- 312.24213 183.4
[M]+ 291.26691 179.8
[M]- 291.26801 179.8
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