CID 44151593

94139-09-0

Structural Information

Molecular Formula
C20H40N2O3
SMILES
CCCCCCCCCCCCCC(=O)N(CCNCC)OC(=O)C
InChI
InChI=1S/C20H40N2O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-20(24)22(25-19(3)23)18-17-21-5-2/h21H,4-18H2,1-3H3
InChIKey
DMPCVHZWDRNIHS-UHFFFAOYSA-N
Compound name
[2-(ethylamino)ethyl-tetradecanoylamino] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.3039 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.31118 198.3
[M+Na]+ 379.29312 198.3
[M-H]- 355.29662 197.5
[M+NH4]+ 374.33772 211.2
[M+K]+ 395.26706 197.1
[M+H-H2O]+ 339.30116 189.9
[M+HCOO]- 401.30210 219.1
[M+CH3COO]- 415.31775 226.2
[M+Na-2H]- 377.27857 195.1
[M]+ 356.30335 205.8
[M]- 356.30445 205.8
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

No patent data available for this compound.