CID 105309

66161-67-9

Structural Information

Molecular Formula
C21H44N2O4
SMILES
CCCCCCCCCCCCCC(=O)NCCC[N+](CCO)(CCO)[O-]
InChI
InChI=1S/C21H44N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-14-21(26)22-15-13-16-23(27,17-19-24)18-20-25/h24-25H,2-20H2,1H3,(H,22,26)
InChIKey
LUYHCRSSXDZZMO-UHFFFAOYSA-N
Compound name
N,N-bis(2-hydroxyethyl)-3-(tetradecanoylamino)propan-1-amine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.3301 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.33738 210.4
[M+Na]+ 411.31932 213.6
[M+NH4]+ 406.36392 216.4
[M+K]+ 427.29326 219.9
[M-H]- 387.32282 203.0
[M+Na-2H]- 409.30477 202.8
[M]+ 388.32955 209.8
[M]- 388.33065 209.8
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.