CID 169396

C10-dichol

Structural Information

Molecular Formula
C18H42N2O2
SMILES
C[N+](C)(CCCCCCCCCC[N+](C)(C)CCO)CCO
InChI
InChI=1S/C18H42N2O2/c1-19(2,15-17-21)13-11-9-7-5-6-8-10-12-14-20(3,4)16-18-22/h21-22H,5-18H2,1-4H3/q+2
InChIKey
GYPLOIGEEGQIPE-UHFFFAOYSA-N
Compound name
2-hydroxyethyl-[10-[2-hydroxyethyl(dimethyl)azaniumyl]decyl]-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

318.32462 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.33190 207.1
[M+Na]+ 341.31384 211.8
[M+NH4]+ 336.35844 213.6
[M+K]+ 357.28778 216.5
[M-H]- 317.31734 200.2
[M+Na-2H]- 339.29929 199.6
[M]+ 318.32407 207.1
[M]- 318.32517 207.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.