CID 13391428

107879-22-1

Structural Information

Molecular Formula

C₂₃H₅₀NO

SMILES

CCCCCCCCCC[N+](C)(CCCCCCCCCC)CCO

InChI

InChI=1S/C23H50NO/c1-4-6-8-10-12-14-16-18-20-24(3,22-23-25)21-19-17-15-13-11-9-7-5-2/h25H,4-23H2,1-3H3/q+1

InChIKey

XUXZYMCUMKODKW-UHFFFAOYSA-N

Compound name

didecyl-(2-hydroxyethyl)-methylazanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 104
Patents: 356.38925 Da
Monoisotopic Mass: 8.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	357.39653	201.6
[M+Na]+	379.37847	201.4
[M-H]-	355.38197	199.1
[M+NH4]+	374.42307	214.6
[M+K]+	395.35241	191.8
[M+H-H2O]+	339.38651	197.1
[M+HCOO]-	401.38745	219.0
[M+CH3COO]-	415.40310	219.1
[M+Na-2H]-	377.36392	203.0
[M]+	356.38870	207.8
[M]-	356.38980	207.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe