CID 4425789

131671-81-3

Structural Information

Molecular Formula
C20H44NO2
SMILES
CCCCCCCCCCCCCC[N+](C)(C)CCOCCO
InChI
InChI=1S/C20H44NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-21(2,3)17-19-23-20-18-22/h22H,4-20H2,1-3H3/q+1
InChIKey
XKOHZCALNKCRTI-UHFFFAOYSA-N
Compound name
2-(2-hydroxyethoxy)ethyl-dimethyl-tetradecylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.33722 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.34450 187.9
[M+Na]+ 353.32644 196.4
[M+NH4]+ 348.37104 194.5
[M+K]+ 369.30038 189.1
[M-H]- 329.32994 188.5
[M+Na-2H]- 351.31189 189.4
[M]+ 330.33667 189.5
[M]- 330.33777 189.5
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.