CID 16733237

N,n-bis(3-aminopropyl)decylamine

Structural Information

Molecular Formula
C16H37N3
SMILES
CCCCCCCCCCN(CCCN)CCCN
InChI
InChI=1S/C16H37N3/c1-2-3-4-5-6-7-8-9-14-19(15-10-12-17)16-11-13-18/h2-18H2,1H3
InChIKey
HKEBWESLPJXKAA-UHFFFAOYSA-N
Compound name
N'-(3-aminopropyl)-N'-decylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

154
Patents

271.29874 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.306016 175.3
[M+Na]+ 294.287958 175.9
[M-H]- 270.291464 173.9
[M+NH4]+ 289.332563 191.0
[M+K]+ 310.261898 173.8
[M+H-H2O]+ 254.296000 167.3
[M+HCOO]- 316.296941 198.0
[M+CH3COO]- 330.312591 214.3
[M+Na-2H]- 292.273406 174.9
[M]+ 271.29819142 177.1
[M]- 271.29928858 177.1
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