CID 5213554

N-(2-hydroxyethyl)-n,n-dimethyl-1-tetradecanaminium chloride

Structural Information

Molecular Formula
C18H40NO
SMILES
CCCCCCCCCCCCCC[N+](C)(C)CCO
InChI
InChI=1S/C18H40NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19(2,3)17-18-20/h20H,4-18H2,1-3H3/q+1
InChIKey
WYWPHTQMLPHMKP-UHFFFAOYSA-N
Compound name
2-hydroxyethyl-dimethyl-tetradecylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

172
Patents

286.311 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.31828 176.3
[M+Na]+ 309.30022 185.7
[M+NH4]+ 304.34482 183.8
[M+K]+ 325.27416 178.3
[M-H]- 285.30372 177.5
[M+Na-2H]- 307.28567 178.7
[M]+ 286.31045 178.2
[M]- 286.31155 178.2
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

patents stripe