CID 3017415

N-(2-aminoethyl)-n-(2-hydroxyethyl)dodecanamide

Structural Information

Molecular Formula
C16H34N2O2
SMILES
CCCCCCCCCCCC(=O)N(CCN)CCO
InChI
InChI=1S/C16H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-16(20)18(13-12-17)14-15-19/h19H,2-15,17H2,1H3
InChIKey
KOUNBXVVHJVUQL-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-N-(2-hydroxyethyl)dodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

286.26202 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.269296 178.3
[M+Na]+ 309.251238 179.4
[M-H]- 285.254744 176.1
[M+NH4]+ 304.295843 193.1
[M+K]+ 325.225178 177.5
[M+H-H2O]+ 269.259280 170.8
[M+HCOO]- 331.260221 198.8
[M+CH3COO]- 345.275871 210.5
[M+Na-2H]- 307.236686 176.8
[M]+ 286.26147142 181.4
[M]- 286.26256858 181.4
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