CID 3607463

13018-95-6

Structural Information

Molecular Formula

C₂₂H₄₈NO

SMILES

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

InChI

InChI=1S/C22H48NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22-24/h24H,4-22H2,1-3H3/q+1

InChIKey

KDOKFXJQGPCGLT-UHFFFAOYSA-N

Compound name

2-hydroxyethyl-dimethyl-octadecylazanium

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 678
Patents: 342.3736 Da
Monoisotopic Mass: 8.4
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]+	343.38088	194.0
[M+Na]+	365.36282	202.6
[M+NH4]+	360.40742	200.8
[M+K]+	381.33676	194.2
[M-H]-	341.36632	195.0
[M+Na-2H]-	363.34827	195.4
[M]+	342.37305	195.7
[M]-	342.37415	195.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe