CID 32367

Diethylenetriamine, 1,1,4,7,7-pentaethyl-

Structural Information

Molecular Formula
C14H33N3
SMILES
CCN(CC)CCN(CC)CCN(CC)CC
InChI
InChI=1S/C14H33N3/c1-6-15(7-2)11-13-17(10-5)14-12-16(8-3)9-4/h6-14H2,1-5H3
InChIKey
LIGIARLVFBHRJF-UHFFFAOYSA-N
Compound name
N'-[2-(diethylamino)ethyl]-N,N,N'-triethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

342
Patents

243.26744 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.27472 169.0
[M+Na]+ 266.25666 170.8
[M-H]- 242.26016 172.1
[M+NH4]+ 261.30126 187.6
[M+K]+ 282.23060 172.6
[M+H-H2O]+ 226.26470 161.0
[M+HCOO]- 288.26564 194.5
[M+CH3COO]- 302.28129 216.6
[M+Na-2H]- 264.24211 169.9
[M]+ 243.26689 174.6
[M]- 243.26799 174.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe