CID 33292

26072-72-0

Structural Information

Molecular Formula
C24H51N2O2
SMILES
CCCCCCCCCCCCCCCCOC(=O)C[N+](C)(C)CCN(C)C
InChI
InChI=1S/C24H51N2O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-28-24(27)23-26(4,5)21-20-25(2)3/h6-23H2,1-5H3/q+1
InChIKey
WLHZAVNQSDLHBV-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl-(2-hexadecoxy-2-oxoethyl)-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

399.39505 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.40233 211.7
[M+Na]+ 422.38427 244.8
[M-H]- 398.38777 228.7
[M+NH4]+ 417.42887 238.1
[M+K]+ 438.35821 203.7
[M+H-H2O]+ 382.39231 206.1
[M+HCOO]- 444.39325 247.1
[M+CH3COO]- 458.40890 233.5
[M+Na-2H]- 420.36972 211.6
[M]+ 399.39450 234.1
[M]- 399.39560 234.1
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.