CID 171762

Einecs 266-198-8

Structural Information

Molecular Formula
C19H40N2O3
SMILES
CCCCCCCCCCCC(=O)NCCCN(CCO)CCO
InChI
InChI=1S/C19H40N2O3/c1-2-3-4-5-6-7-8-9-10-12-19(24)20-13-11-14-21(15-17-22)16-18-23/h22-23H,2-18H2,1H3,(H,20,24)
InChIKey
OQRZKRYPYZNLFV-UHFFFAOYSA-N
Compound name
N-[3-[bis(2-hydroxyethyl)amino]propyl]dodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

344.3039 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.31118 193.5
[M+Na]+ 367.29312 192.7
[M-H]- 343.29662 189.7
[M+NH4]+ 362.33772 205.3
[M+K]+ 383.26706 190.1
[M+H-H2O]+ 327.30116 185.3
[M+HCOO]- 389.30210 212.3
[M+CH3COO]- 403.31775 219.5
[M+Na-2H]- 365.27857 191.2
[M]+ 344.30335 198.2
[M]- 344.30445 198.2
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.